data_1ss6_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 1ss6 _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 ' 14' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.69 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.915 HD23 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.728 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.75 ' HB2' ' HZ3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.624 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.915 ' HB2' HD23 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.427 ' C ' HD22 ' A' ' 25' ' ' LEU . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.69 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.449 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.806 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.645 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.624 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.639 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.645 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.704 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.486 HD12 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.501 HG23 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.561 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.501 HH11 HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.419 HG23 ' HD2' ' A' ' 55' ' ' ARG . 46.0 t . . . . . 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.457 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.577 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.572 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.577 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.806 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 26' ' ' ASP . 15.3 m . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.936 HD23 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.537 ' HZ1' ' CD ' ' A' ' 68' ' ' GLU . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.805 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.936 ' HB2' HD23 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.56 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.613 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.521 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.508 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 p30 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.805 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.602 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.646 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.646 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.684 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.487 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.684 ' HB3' HE22 ' A' ' 40' ' ' GLN . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.492 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.445 -0.687 0 CA-C-O 121.307 0.575 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.727 HD12 HD11 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.537 ' CD ' ' HZ1' ' A' ' 17' ' ' LYS . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.452 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.727 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 N--CA 1.449 -0.513 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.705 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.733 HD11 HD22 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.627 ' HB2' ' HG ' ' A' ' 24' ' ' SER . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.929 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.61 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.655 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.627 ' HG ' ' HB2' ' A' ' 17' ' ' LYS . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.705 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.929 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.464 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.63 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.63 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.415 HE22 ' CG ' ' A' ' 53' ' ' GLU . 12.2 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.655 ' HB2' ' HZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.676 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.433 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.676 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.517 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.659 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.659 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 . . . . . 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.5 m . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.733 HD22 HD11 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.409 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.604 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.61 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.662 ' HD1' ' CZ2' ' A' ' 19' ' ' TRP . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.443 -0.802 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.56 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HZ1' ' CD ' ' A' ' 68' ' ' GLU . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.536 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.803 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.471 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.508 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.873 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.578 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.56 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.426 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.803 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.508 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.473 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.598 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.466 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.543 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 35' ' ' ASP . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.671 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.71 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.71 ' HB3' HE22 ' A' ' 40' ' ' GLN . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.596 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.664 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.811 HG23 HD22 ' A' ' 54' ' ' LEU . 77.4 t . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.836 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.801 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.836 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.893 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.51 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.464 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.801 ' HB2' HD22 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.596 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.633 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.738 ' HB2' HG12 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.893 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.506 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.729 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.729 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.679 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.708 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.603 HD12 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.621 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.479 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.679 ' HB3' HE22 ' A' ' 40' ' ' GLN . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.708 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.811 HD22 HG23 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.446 -0.66 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.478 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.478 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.606 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.505 HG11 ' O ' ' A' ' 76' ' ' VAL . 7.5 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.8 HG11 HD21 ' A' ' 54' ' ' LEU . 40.6 t . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.491 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.785 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.578 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.487 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.63 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.44 ' HB2' HG12 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.459 HD22 ' CD1' ' A' ' 25' ' ' LEU . 11.4 p30 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.488 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.792 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.792 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.629 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.753 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.418 HD13 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.72 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.72 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.488 HG12 HG11 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.629 ' HB3' HE22 ' A' ' 40' ' ' GLN . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.753 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.8 HD21 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.656 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.488 HG11 HG12 ' A' ' 50' ' ' VAL . 2.6 p . . . . . 0 N--CA 1.437 -1.117 0 CA-C-O 121.712 0.768 . . . . 0.0 108.974 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.423 HD12 ' HE2' ' A' ' 67' ' ' MET . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.423 ' HE2' HD12 ' A' ' 65' ' ' LEU . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.518 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.402 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.518 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.541 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.669 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 74' ' ' ASP . 4.9 t . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.512 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.67 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.838 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.468 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.494 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.911 ' HB2' HD22 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.67 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.838 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.646 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.494 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.651 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.651 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.554 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.438 HG12 ' HA ' ' A' ' 55' ' ' ARG . 5.2 m . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.86 HD13 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.468 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.413 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.62 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.666 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.0 t . . . . . 0 N--CA 1.444 -0.733 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.88 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.459 ' HZ3' ' CD ' ' A' ' 68' ' ' GLU . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.923 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 74' ' ' ASP . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.583 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.88 ' HB2' HD22 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.517 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.615 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.923 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.765 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.67 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.765 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.707 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.8 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.655 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.655 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.707 ' HB3' HE22 ' A' ' 40' ' ' GLN . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.8 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.406 ' N ' HD21 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.502 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.566 HD12 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.566 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 17' ' ' LYS . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 20' ' ' LYS . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.644 ' HB2' HD11 ' A' ' 30' ' ' LEU . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.439 HG11 ' O ' ' A' ' 76' ' ' VAL . 7.2 p . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.625 HG23 HD22 ' A' ' 54' ' ' LEU . 36.0 t . . . . . 0 CA--C 1.507 -0.71 0 CA-C-O 121.098 0.475 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HE2' ' OE1' ' A' ' 68' ' ' GLU . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.682 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.542 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.73 ' HB2' HD22 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.682 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.442 HD21 HD22 ' A' ' 27' ' ' ASN . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.442 HD22 HD21 ' A' ' 25' ' ' LEU . 1.2 p-10 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.502 ' CD2' ' HB2' ' A' ' 75' ' ' PHE . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.434 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.542 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.773 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.773 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.6 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.554 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.693 HG12 HD13 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.6 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.693 HD13 HG12 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.581 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.451 -0.378 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.598 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.421 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.534 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.641 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.473 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.502 ' HB2' ' CD2' ' A' ' 30' ' ' LEU . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.546 HG21 HD11 ' A' ' 54' ' ' LEU . 1.9 m . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.513 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.501 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.425 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.721 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.862 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.617 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.579 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.597 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.512 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.634 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.541 ' HB3' HG13 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.634 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.862 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.579 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.597 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.521 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.583 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.843 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.588 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.843 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.479 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.721 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.508 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.659 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 76' ' ' VAL . 7.0 p . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.779 HG13 HD22 ' A' ' 54' ' ' LEU . 13.1 m . . . . . 0 N--CA 1.441 -0.894 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.813 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.541 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.768 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.405 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.688 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.467 ' OD1' HD13 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.813 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.541 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 34' ' ' GLN . 15.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.47 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.443 HD13 HD11 ' A' ' 16' ' ' LEU . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.717 HG21 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.779 HD22 HG13 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.717 HG11 HG21 ' A' ' 50' ' ' VAL . 54.5 t . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.785 0.326 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.433 HD11 HD11 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.447 ' HE2' HD13 ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.68 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.623 ' HB2' HD11 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.751 HG12 HD22 ' A' ' 54' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.45 -0.445 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.836 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 HD11 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.836 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.471 ' HG ' ' CG ' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.631 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.572 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.568 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.4 HD22 HD12 ' A' ' 25' ' ' LEU . 9.6 p30 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HB3' ' H ' ' A' ' 30' ' ' LEU . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.761 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.631 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.655 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.655 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.44 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.642 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.683 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.576 HD11 HD11 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.484 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.528 HG11 HG12 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.44 ' HB3' HE22 ' A' ' 40' ' ' GLN . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.642 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.751 HD22 HG12 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.528 HG12 HG11 ' A' ' 50' ' ' VAL . 7.4 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.641 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' CG ' ' HG ' ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.641 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.628 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.859 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.469 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.65 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.537 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.421 ' HB3' HG11 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.859 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.424 ' N ' HD22 ' A' ' 30' ' ' LEU . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.65 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.532 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.532 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.885 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.885 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.733 HG21 HG13 ' A' ' 63' ' ' VAL . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.492 ' HD2' HD12 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.699 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.492 HD12 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.722 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.733 HG13 HG21 ' A' ' 50' ' ' VAL . 3.6 p . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.617 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.448 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.534 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.413 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.661 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.899 HG12 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.625 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.899 ' HE3' HG12 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.945 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.625 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.554 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.505 HD21 ' N ' ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.945 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.648 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.578 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.772 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.772 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.512 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.534 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.626 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 121.509 0.671 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.58 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.434 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.579 ' HB2' HD11 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.469 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.118 0.485 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 15' ' ' VAL . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.651 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HZ3' ' CD ' ' A' ' 68' ' ' GLU . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.553 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.846 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.451 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.694 ' HB3' ' HH ' ' A' ' 33' ' ' TYR . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.651 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.478 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.469 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.445 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.9 p30 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.846 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.51 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.53 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.694 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.661 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.661 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.539 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.445 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.464 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.655 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.562 ' CD ' ' HZ3' ' A' ' 17' ' ' LYS . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.567 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.434 ' C ' ' H ' ' A' ' 73' ' ' GLU . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.567 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.688 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.694 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.516 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HZ2' ' CD ' ' A' ' 68' ' ' GLU . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.605 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.869 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.517 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.516 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.59 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.438 HD22 ' CD2' ' A' ' 54' ' ' LEU . 2.1 m-80 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.869 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.725 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.517 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.658 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.725 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.732 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.732 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.525 ' HD2' HD13 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.694 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.73 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.605 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.569 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.665 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 54' ' ' LEU . 33.1 t . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.624 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.959 HD22 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 68' ' ' GLU . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.594 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.959 ' HB2' HD22 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.624 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.634 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.65 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.65 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.652 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.585 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.585 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.431 HD21 ' HA ' ' A' ' 64' ' ' ASN . 1.7 t-20 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.569 HD13 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.495 ' O ' ' HA ' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.588 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.571 ' CG ' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.624 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' O ' ' A' ' 76' ' ' VAL . 9.2 p . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.81 HG12 HD12 ' A' ' 54' ' ' LEU . 2.5 p . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.511 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.951 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.53 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.677 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.494 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.498 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.473 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.498 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.951 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.677 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.61 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.664 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.664 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.539 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.683 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.543 HG12 HG13 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.81 HD12 HG12 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.543 HG13 HG12 ' A' ' 50' ' ' VAL . 2.4 p . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 121.098 0.475 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . 0.431 HD21 ' HA ' ' A' ' 64' ' ' ASN . 2.0 t-20 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.479 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' MET . . . . . 0.511 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.425 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.435 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.53 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.58 ' HB2' HD12 ' A' ' 30' ' ' LEU . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 9.8 m . . . . . 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.477 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.356 0.598 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.797 HD23 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.869 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.797 ' HB2' HD23 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.532 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.869 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.459 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.727 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.534 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.498 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.448 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.569 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.448 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.546 HD11 HD11 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.432 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.62 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.656 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.465 HG21 HD12 ' A' ' 54' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.432 -1.369 0 CA-C-O 121.696 0.76 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.811 HD23 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.544 ' HZ2' ' CD ' ' A' ' 68' ' ' GLU . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.423 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.901 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.495 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.811 ' HB2' HD23 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.583 ' CD1' ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.429 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ARG . . . . . 0.63 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.423 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.577 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.449 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.52 HG12 HG22 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.449 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.631 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.52 HG22 HG12 ' A' ' 50' ' ' VAL . 41.6 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.544 ' CD ' ' HZ2' ' A' ' 17' ' ' LYS . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.7 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLU . . . . . 0.611 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PHE . . . . . 0.579 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -78.87 -40.13 33.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 67.95 -75.38 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.652 0.595 . . . . 0.0 111.427 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.518 ' HZ2' ' HB2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -154.4 79.12 1.1 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 0.0 110.328 -178.927 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.79 -74.62 0.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -173.57 158.98 3.51 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.841 176.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -87.84 94.03 9.64 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 m -39.06 109.14 0.1 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 124.489 1.118 . . . . 0.0 112.877 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.7 t -80.84 72.4 7.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.442 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -117.88 23.45 11.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.052 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.451 ' HB3' ' NE2' ' A' ' 62' ' ' GLN . 10.4 m-20 56.39 88.42 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.871 177.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.416 ' CG2' ' HB2' ' A' ' 58' ' ' ALA . 14.5 m -119.2 167.18 12.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.527 0.68 . . . . 0.0 112.118 -167.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -104.18 132.54 50.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.117 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m -103.42 111.97 35.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 171.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.69 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.915 HD23 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.749 ' HZ1' ' HA ' ' A' ' 83' ' ' LYS . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.728 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.75 ' HB2' ' HZ3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.624 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.915 ' HB2' HD23 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.427 ' C ' HD22 ' A' ' 25' ' ' LEU . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.713 HD11 HD23 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.69 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.449 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.806 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.645 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.624 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.639 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.645 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.704 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.486 HD12 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.704 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.501 HG23 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.561 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.713 HD23 HD11 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.501 HH11 HG23 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -74.51 -21.12 59.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 37.6 mmt180 -87.32 9.68 19.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.86 170.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -113.17 -58.83 2.1 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 1.002 ' HB1' HG22 ' A' ' 63' ' ' VAL . . . -90.41 160.03 16.27 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.232 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.444 ' C ' ' H ' ' A' ' 61' ' ' GLY . 0.2 OUTLIER -59.78 160.68 7.2 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 169.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.34 33.13 0.55 Allowed Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.906 -0.664 . . . . 0.0 114.399 -170.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.444 ' H ' ' C ' ' A' ' 59' ' ' HIS . . . -102.08 -131.09 7.23 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 176.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.451 ' NE2' ' HB3' ' A' ' 11' ' ' ASP . 28.0 tt0 -66.59 87.0 0.12 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.393 0.616 . . . . 0.0 111.29 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 1.002 HG22 ' HB1' ' A' ' 58' ' ' ALA . 46.0 t -97.1 101.45 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 165.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.457 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.443 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.577 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.572 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.577 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.806 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.33 97.94 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.673 ' CB ' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -138.77 -65.06 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.804 0 O-C-N 122.215 -0.303 . . . . 0.0 111.393 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.673 ' HD3' ' CB ' ' A' ' 77' ' ' LYS . 23.5 Cg_exo -71.62 -32.22 12.27 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 123.862 3.041 . . . . 0.0 111.851 174.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -36.41 -48.84 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 113.687 -1.597 . . . . 0.0 113.605 -177.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 163.0 172.92 31.09 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.332 -0.937 . . . . 0.0 111.8 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 62.04 -169.64 0.17 Allowed 'General case' 0 C--O 1.232 0.144 0 O-C-N 124.062 0.507 . . . . 0.0 110.62 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.46 ' C ' ' H ' ' A' ' 84' ' ' ALA . 85.9 m-85 -128.15 136.68 51.46 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.749 ' HA ' ' HZ1' ' A' ' 17' ' ' LYS . 16.6 mtmt 64.9 -7.59 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.74 0.816 . . . . 0.0 112.748 -175.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.46 ' H ' ' C ' ' A' ' 82' ' ' PHE . . . 61.42 35.17 17.87 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.076 0.55 . . . . 0.0 110.984 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.557 ' HB2' ' HA ' ' A' ' 91' ' ' LYS . 96.3 m-85 66.04 72.41 0.4 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.459 175.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.92 12.79 32.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.495 173.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -90.18 103.32 3.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.803 -175.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 52.35 79.15 0.11 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.516 0.674 . . . . 0.0 110.845 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.72 -157.23 15.34 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -175.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.433 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 2.8 tp-100 -150.08 109.87 4.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 117.152 0.476 . . . . 0.0 110.713 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.557 ' HA ' ' HB2' ' A' ' 85' ' ' PHE . 5.7 ttpm? 72.96 -40.07 0.46 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.825 0.85 . . . . 0.0 111.656 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.2 mt 54.19 59.65 4.08 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.783 0.433 . . . . 0.0 111.824 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.62 -30.81 4.42 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.044 -0.598 . . . . 0.0 113.657 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.53 ' HB3' ' CG ' ' A' ' 91' ' ' LYS . 38.0 p 46.61 51.07 12.43 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.215 0.531 . . . . 0.0 111.383 -176.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 p -80.83 57.84 3.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 111.377 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.75 90.79 32.91 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.975 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.45 -9.21 25.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.57 2.18 . . . . 0.0 112.381 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.92 166.5 17.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.766 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.8 t -95.54 -36.55 6.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.081 0.467 . . . . 0.0 110.806 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 52.0 mt -105.34 160.85 14.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.736 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.9 m 69.31 14.9 8.54 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.501 0.501 . . . . 0.0 111.817 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.3 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.819 176.499 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.944 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -79.97 87.58 5.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.406 ' OE2' ' HD2' ' A' ' 5' ' ' ARG . 10.3 pt-20 -137.48 176.81 8.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.189 0.518 . . . . 0.0 111.459 -169.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 11.0 mptt -95.33 -7.82 37.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.328 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.455 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 7.3 tpt180 68.72 -86.88 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.914 177.32 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.455 ' H ' ' HB3' ' A' ' 5' ' ' ARG . 94.3 mt-30 52.95 -103.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.955 0.502 . . . . 0.0 111.722 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.0 m170 66.38 -77.27 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.984 0.513 . . . . 0.0 111.211 -175.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.505 ' HB3' ' O ' ' A' ' 11' ' ' ASP . 27.8 m -97.43 113.13 24.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.969 0.414 . . . . 0.0 110.14 -178.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 p -101.58 -49.02 4.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 110.74 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -83.74 -48.31 10.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.468 -178.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.538 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 6.6 p-10 -145.6 144.55 30.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.701 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.563 HG11 HG22 ' A' ' 63' ' ' VAL . 2.5 p -111.98 119.04 59.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.109 168.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -112.02 104.34 12.59 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.521 HG12 ' HB3' ' A' ' 26' ' ' ASP . 15.3 m -104.55 127.87 58.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 -178.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.602 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.936 HD23 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.647 ' CE ' ' HA ' ' A' ' 78' ' ' PRO . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.805 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.936 ' HB2' HD23 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.56 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.613 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.521 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.508 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 p30 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.805 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.602 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.646 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.646 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.684 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.487 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.684 ' HB3' HE22 ' A' ' 40' ' ' GLN . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.487 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.492 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.14 -44.23 84.79 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.402 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 25.3 mmt180 -83.03 44.9 0.97 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.285 0.564 . . . . 0.0 109.933 178.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -137.03 -58.14 0.71 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.508 ' HB3' ' HB ' ' A' ' 12' ' ' VAL . . . -75.7 141.33 42.71 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.942 170.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -45.66 -49.46 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.691 0.619 . . . . 0.0 112.283 -173.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 160.46 71.67 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 119.84 -1.172 . . . . 0.0 113.628 173.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -156.43 -127.73 1.03 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.858 168.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.538 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 31.7 tt0 -52.04 116.42 2.18 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.33 0.586 . . . . 0.0 111.155 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.563 HG22 HG11 ' A' ' 12' ' ' VAL . 3.6 p -133.92 104.51 6.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.17 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.727 HD12 HD11 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.482 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.537 ' CD ' ' HZ1' ' A' ' 17' ' ' LYS . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.6 ' HE1' HG23 ' A' ' 86' ' ' THR . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.757 ' CZ ' ' HD3' ' A' ' 78' ' ' PRO . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.9 p -106.08 6.45 10.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.733 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 4.2 mtpt 80.9 144.84 0.09 OUTLIER Pre-proline 0 N--CA 1.47 0.54 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.053 177.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.757 ' HD3' ' CZ ' ' A' ' 75' ' ' PHE . 17.2 Cg_exo -68.86 -76.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.641 2.227 . . . . 0.0 110.643 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.828 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.6 mmpt? 66.02 -76.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 O-C-N 123.858 0.724 . . . . 0.0 111.417 170.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.401 ' C ' ' H ' ' A' ' 82' ' ' PHE . . . 107.94 94.65 2.36 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.36 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.502 ' H ' ' HB2' ' A' ' 85' ' ' PHE . . . 72.71 -34.75 0.31 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.726 0.81 . . . . 0.0 112.557 176.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.401 ' H ' ' C ' ' A' ' 80' ' ' GLY . 57.5 m-85 -52.26 -39.9 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.14 0.495 . . . . 0.0 110.397 175.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.53 ' HZ1' ' HB3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -157.45 130.87 7.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.607 174.218 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 59.84 51.85 5.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.522 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.502 ' HB2' ' H ' ' A' ' 81' ' ' ALA . 42.3 t80 -90.33 59.24 4.31 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 172.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.6 HG23 ' HE1' ' A' ' 70' ' ' HIS . 2.8 t -114.45 74.49 0.88 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.029 -172.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.88 -46.31 5.71 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.219 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -87.63 89.06 7.85 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 139.24 72.32 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -176.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -100.6 167.95 10.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 110.896 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -73.44 104.71 4.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.063 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.5 63.7 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -142.04 164.49 26.82 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.79 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.5 m 59.21 51.52 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.334 0.588 . . . . 0.0 109.933 -176.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.7 p -76.51 77.18 3.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.454 -175.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -127.54 99.5 26.86 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.94 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.64 -51.58 9.51 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.049 2.499 . . . . 0.0 111.656 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 59.4 178.87 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.85 0.833 . . . . 0.0 113.085 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.9 p -89.57 -28.02 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.962 176.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.7 mt -147.6 135.82 21.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.062 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.2 m 62.38 -161.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.728 0.642 . . . . 0.0 111.814 173.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.454 -177.614 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t 65.13 -173.83 0.18 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.008 0.523 . . . . 0.0 110.825 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -138.06 148.39 45.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.443 -177.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 32.9 ttpt 59.31 53.12 5.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.436 0.636 . . . . 0.0 110.664 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 5' ' ' ARG . 10.0 mmm180 -130.35 177.87 7.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.855 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 65.6 174.38 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.872 0.732 . . . . 0.0 110.931 -177.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.434 ' HB2' ' OE1' ' A' ' 10' ' ' GLN . 28.1 m80 -63.68 -62.19 1.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.076 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.407 ' C ' ' H ' ' A' ' 10' ' ' GLN . 23.3 t 69.93 -50.76 0.64 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.593 -176.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.616 ' HA ' ' HB2' ' A' ' 59' ' ' HIS . 19.8 m -74.01 44.6 0.19 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 111.437 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.434 ' OE1' ' HB2' ' A' ' 7' ' ' HIS . 28.1 mt-30 -95.41 -12.95 25.1 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.578 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 73.4 m-20 62.25 165.58 0.1 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.933 -175.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.583 HG13 ' HB2' ' A' ' 58' ' ' ALA . 2.1 m -125.21 126.6 71.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.269 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -103.86 103.14 12.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 167.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -102.78 117.2 47.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.705 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.733 HD11 HD22 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.627 ' HB2' ' HG ' ' A' ' 24' ' ' SER . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.929 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.61 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.655 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.627 ' HG ' ' HB2' ' A' ' 17' ' ' LYS . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.705 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.929 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.464 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.462 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.63 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.63 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.415 HE22 ' CG ' ' A' ' 53' ' ' GLU . 12.2 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.655 ' HB2' ' HZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.676 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.433 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.676 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.517 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.659 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.593 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.659 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 -64.73 -45.62 85.72 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.456 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 17.0 mmt180 -88.13 36.42 0.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.456 174.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.526 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER -120.7 -56.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 168.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.583 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -77.36 178.98 6.72 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.29 165.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.616 ' HB2' ' HA ' ' A' ' 9' ' ' SER . 1.9 t-80 -56.67 -26.65 57.0 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.711 169.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 110.72 6.35 26.79 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.289 -176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.61 -94.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.666 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.578 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 6.0 tt0 -84.24 83.47 7.96 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.755 0.788 . . . . 0.0 109.172 178.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 5.5 m -93.35 102.24 13.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.318 175.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.733 HD22 HD11 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.409 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.604 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.629 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.61 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.604 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.772 ' CZ ' ' HE3' ' A' ' 77' ' ' LYS . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p -90.31 -9.27 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.772 ' HE3' ' CZ ' ' A' ' 75' ' ' PHE . 19.7 mtpt 77.51 143.74 0.1 OUTLIER Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 114.545 -1.207 . . . . 0.0 113.452 168.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.459 ' HB3' HG11 ' A' ' 15' ' ' VAL . 10.9 Cg_exo -77.85 -61.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.085 2.524 . . . . 0.0 109.603 163.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -70.25 97.29 1.21 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.407 -1.27 . . . . 0.0 109.86 171.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 130.84 -0.62 5.41 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 -175.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.15 -172.57 2.16 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -110.67 -54.26 2.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.63 0.252 . . . . 0.0 110.905 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -88.2 -27.03 22.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.295 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 66.66 -67.16 0.16 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 124.079 0.862 . . . . 0.0 112.305 176.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -106.51 127.58 53.42 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 2.8 m -72.43 -35.42 68.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.596 -174.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 122.83 121.41 2.68 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 41.98 35.42 0.55 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.101 0.96 . . . . 0.0 111.835 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.58 -95.12 0.12 Allowed Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.4 -174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -176.39 43.22 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.419 ' HB3' ' H ' ' A' ' 92' ' ' LEU . 44.8 mmtm 63.88 -141.64 0.31 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.596 -173.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.419 ' H ' ' HB3' ' A' ' 91' ' ' LYS . 81.2 mt 71.97 -71.6 0.13 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.958 0.503 . . . . 0.0 111.4 177.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.97 8.16 57.56 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.382 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -70.39 -25.76 63.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.97 0.414 . . . . 0.0 111.227 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.9 m -154.35 136.21 14.54 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.863 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 66.25 84.15 0.18 Allowed Pre-proline 0 CA--C 1.533 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 111.414 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.551 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 33.2 Cg_endo -64.9 118.86 5.8 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.838 2.359 . . . . 0.0 112.537 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.659 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 19.8 pt20 46.27 -81.68 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.974 1.31 . . . . 0.0 113.945 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.659 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 9.6 p -122.5 0.71 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.307 0.575 . . . . 0.0 111.014 -175.064 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.551 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 54.4 mt -95.43 117.55 30.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.925 -177.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -90.06 -14.88 32.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.796 0.332 . . . . 0.0 110.288 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.245 -179.862 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 112.229 -0.349 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m -137.64 142.4 41.18 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 177.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.54 -50.26 1.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.147 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.435 ' HE2' ' O ' ' A' ' 59' ' ' HIS . 86.8 mttt 54.69 41.82 31.66 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.753 0.787 . . . . 0.0 109.138 -175.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -107.9 -58.71 1.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.472 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -132.68 -32.45 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.55 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -92.79 41.39 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.503 0.668 . . . . 0.0 109.355 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 m -75.01 102.87 4.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.346 -0.843 . . . . 0.0 108.822 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.624 ' C ' ' H ' ' A' ' 11' ' ' ASP . 2.0 m -59.46 -51.73 68.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.665 -171.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.84 ' H ' ' HA3' ' A' ' 60' ' ' GLY . 0.0 OUTLIER 70.15 -24.26 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.085 0.954 . . . . 0.0 110.826 -177.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.624 ' H ' ' C ' ' A' ' 9' ' ' SER . 1.0 OUTLIER -174.13 130.76 0.39 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.451 177.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.608 HG12 ' HB3' ' A' ' 9' ' ' SER . 35.2 m -137.95 144.38 31.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.4 0.619 . . . . 0.0 110.187 172.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -102.64 129.82 49.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.913 169.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.27 104.79 16.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.723 HG13 ' HG2' ' A' ' 78' ' ' PRO . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.873 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HZ1' ' CD ' ' A' ' 68' ' ' GLU . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.536 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.803 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.471 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.508 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.873 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.578 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.56 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.426 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.803 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.508 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.473 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.598 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.466 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.543 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 35' ' ' ASP . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.671 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.71 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.517 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.445 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.71 ' HB3' HE22 ' A' ' 40' ' ' GLN . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD12 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.596 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -63.65 -43.69 96.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.0 mmt85 -86.25 22.23 1.85 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.647 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.6 tt -111.09 -50.33 2.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 171.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB3' ' CG2' ' A' ' 12' ' ' VAL . . . -59.6 124.72 21.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.313 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.435 ' O ' ' HE2' ' A' ' 4' ' ' LYS . 30.4 m170 -99.27 -12.79 20.05 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.556 -175.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.84 ' HA3' ' H ' ' A' ' 10' ' ' GLN . . . -93.23 -51.8 2.16 Favored Glycine 0 CA--C 1.503 -0.662 0 C-N-CA 120.455 -0.878 . . . . 0.0 111.843 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 158.58 -63.57 0.3 Allowed Glycine 0 CA--C 1.494 -1.23 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.661 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.586 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 8.2 tt0 -62.25 108.64 1.12 Allowed 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.183 0.516 . . . . 0.0 111.216 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.32 102.98 11.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.119 175.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.856 HD13 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.536 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.61 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.61 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.664 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.2 p -148.07 -46.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.804 ' HB3' ' HG3' ' A' ' 79' ' ' LYS . 6.2 mtpt 64.0 164.86 0.12 Allowed Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 176.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.723 ' HG2' HG13 ' A' ' 15' ' ' VAL . 16.9 Cg_exo -71.83 -65.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.475 2.783 . . . . 0.0 110.156 170.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.804 ' HG3' ' HB3' ' A' ' 77' ' ' LYS . 53.2 mtpt 50.39 -103.91 0.14 Allowed 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.713 0.633 . . . . 0.0 112.431 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.94 6.21 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.497 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -105.21 -41.02 5.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.66 -0.27 . . . . 0.0 110.498 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 52.18 53.38 12.54 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 123.549 0.531 . . . . 0.0 110.051 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.502 ' HE3' ' HB2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.2 -39.22 89.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.671 -172.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.409 ' HB3' ' HD3' ' A' ' 83' ' ' LYS . . . -169.41 159.25 8.51 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.956 0.408 . . . . 0.0 111.285 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -138.6 47.2 1.97 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.566 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.7 p -97.39 127.88 43.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.33 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.463 ' O ' ' HB3' ' A' ' 88' ' ' GLU . . . -129.02 148.09 17.98 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 174.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.463 ' HB3' ' O ' ' A' ' 87' ' ' GLY . 14.4 tp10 77.2 -40.81 0.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.44 0.696 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -125.33 93.91 0.44 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.161 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -83.56 -29.32 27.93 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -110.84 83.73 1.81 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.583 173.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 pp -102.24 19.75 18.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.078 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.02 65.11 0.56 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.445 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.1 m -124.13 177.72 5.68 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.791 -0.078 . . . . 0.0 110.791 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.8 p 49.9 82.65 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.367 0.667 . . . . 0.0 111.902 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -165.42 97.73 0.81 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.59 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 22.6 Cg_exo -65.0 87.48 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.288 2.658 . . . . 0.0 112.81 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -134.95 -154.15 0.56 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.082 178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 48.5 t -67.7 -44.48 85.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.332 0.587 . . . . 0.0 109.557 175.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.3 mp -105.32 161.14 14.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.773 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t 73.82 -84.16 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.182 175.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.408 ' HA ' ' HA ' ' A' ' 97' ' ' PRO . 79.5 m . . . . . 0 C--O 1.251 1.18 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -167.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 111.546 -0.621 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.2 m -137.35 123.85 20.86 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.714 0.293 . . . . 0.0 110.726 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -141.76 137.31 31.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -84.64 130.19 34.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.295 0.569 . . . . 0.0 110.276 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.759 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 0.4 OUTLIER -86.38 -151.93 0.17 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.234 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.759 ' H ' ' HG3' ' A' ' 5' ' ' ARG . 5.6 mm100 -63.87 -45.67 88.4 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -176.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -137.47 149.79 47.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.102 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.1 p -122.21 37.27 4.42 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.781 0.324 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 p -133.38 28.37 4.04 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -175.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 28.28 3.1 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.357 -0.214 . . . . 0.0 110.665 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.728 ' HA ' ' CA ' ' A' ' 62' ' ' GLN . 10.7 m-20 20.31 104.37 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.796 1.638 . . . . 0.0 113.956 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.531 HG22 ' O ' ' A' ' 62' ' ' GLN . 26.7 m -59.05 164.16 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 120.995 0.426 . . . . 0.0 110.78 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -124.72 107.8 11.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.192 0.52 . . . . 0.0 110.379 -174.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.811 HG23 HD22 ' A' ' 54' ' ' LEU . 77.4 t -104.06 114.55 43.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.342 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.836 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.801 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.862 ' HZ1' ' HG3' ' A' ' 78' ' ' PRO . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.893 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.51 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.464 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.801 ' HB2' HD22 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.596 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.633 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.738 ' HB2' HG12 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.893 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.506 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.464 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.729 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.729 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.679 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.708 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.621 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.603 HD12 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.416 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.621 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.479 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.679 ' HB3' HE22 ' A' ' 40' ' ' GLN . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.708 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.811 HD22 HG23 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -40.52 97.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -84.22 43.26 0.93 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.478 0.656 . . . . 0.0 109.994 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 tp -153.75 -49.42 0.09 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.704 176.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.52 ' CB ' ' HB ' ' A' ' 63' ' ' VAL . . . -69.02 148.22 50.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.536 175.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -100.18 125.93 46.39 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -175.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.35 15.12 74.78 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.373 172.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.88 8.6 63.32 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.36 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.728 ' CA ' ' HA ' ' A' ' 11' ' ' ASP . 7.2 tt0 -65.81 62.38 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.907 0.883 . . . . 0.0 110.096 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.52 ' HB ' ' CB ' ' A' ' 58' ' ' ALA . 2.6 p -145.21 123.69 5.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 -174.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.473 HD13 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 90' ' ' GLN . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.478 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.548 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.478 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.606 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.505 HG11 ' O ' ' A' ' 76' ' ' VAL . 7.5 p -175.18 53.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.735 ' HG3' ' HB3' ' A' ' 83' ' ' LYS . 2.0 tppt? -133.73 -56.54 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 O-C-N 121.044 -1.035 . . . . 0.0 113.379 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.862 ' HG3' ' HZ1' ' A' ' 17' ' ' LYS . 39.3 Cg_exo -66.07 -41.27 13.63 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.721 2.281 . . . . 0.0 111.905 175.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -133.05 151.48 52.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.882 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 92.74 -37.51 3.38 Favored Glycine 0 CA--C 1.511 -0.214 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.76 174.46 10.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.71 114.99 28.34 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.9 0.381 . . . . 0.0 110.864 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.735 ' HB3' ' HG3' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.41 96.96 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.484 0.659 . . . . 0.0 110.965 178.871 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -92.12 6.62 45.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.045 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 60.1 t80 64.43 102.59 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.562 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.2 t -141.41 128.7 21.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.452 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.48 -42.9 4.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.141 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -92.45 137.71 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.36 -14.98 25.27 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.617 -178.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.414 ' HB3' ' O ' ' A' ' 69' ' ' ASP . 80.5 mt-30 -70.96 -74.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 109.96 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.891 ' HG2' ' HB2' ' A' ' 94' ' ' SER . 14.0 tppt? 178.02 -61.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.158 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 92' ' ' LEU . 0.3 OUTLIER 59.87 83.31 0.14 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.163 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.87 41.65 0.77 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.673 -177.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.891 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 15.8 t -103.05 121.55 42.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.7 m 60.37 89.07 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 111.517 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.46 ' HB3' ' HA ' ' A' ' 101' ' ' SER . . . -56.8 116.52 13.42 Favored Pre-proline 0 C--O 1.236 0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.013 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.808 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 50.9 Cg_endo -70.96 81.06 1.16 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.045 2.497 . . . . 0.0 112.83 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.708 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 15.3 pt20 44.43 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.283 . . . . 0.0 113.711 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.708 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 12.3 p -72.52 -26.01 23.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.978 0.418 . . . . 0.0 110.969 -176.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.808 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 55.3 mt -105.84 177.01 4.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.839 -177.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.46 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . 32.4 t -138.36 27.82 2.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.142 0.496 . . . . 0.0 109.856 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.142 -178.115 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.694 0 N-CA-C 112.35 -0.3 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -97.85 54.7 1.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.307 . . . . 0.0 111.211 -177.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.409 ' OE1' ' HG2' ' A' ' 4' ' ' LYS . 1.9 tm-20 -59.09 -69.94 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.065 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HB2' ' H ' ' A' ' 5' ' ' ARG . 15.7 pttm -129.17 -155.04 0.67 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.42 ' H ' ' HB2' ' A' ' 4' ' ' LYS . 79.4 mtt180 77.48 -48.2 0.5 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.763 0.825 . . . . 0.0 109.813 -174.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 61.4 25.14 15.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.787 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -123.93 109.92 14.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.433 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m -85.65 -24.01 27.24 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 167.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.5 m -84.87 68.33 10.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.133 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.587 ' HG3' ' HB2' ' A' ' 59' ' ' HIS . 9.6 mm100 -95.81 40.99 1.11 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 173.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.447 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 8.1 p-10 -46.51 111.29 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.644 -174.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.511 HG22 ' HB2' ' A' ' 58' ' ' ALA . 19.2 m -144.75 165.46 12.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.344 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.511 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 16.6 m-70 -116.85 125.72 51.96 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.797 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.8 HG11 HD21 ' A' ' 54' ' ' LEU . 40.6 t -102.8 111.05 31.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.419 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.579 HG12 ' HE2' ' A' ' 83' ' ' LYS . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.416 HD22 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.521 ' HE3' ' HG2' ' A' ' 83' ' ' LYS . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.785 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.49 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.578 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.532 ' OG ' ' HG2' ' A' ' 78' ' ' PRO . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.63 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.44 ' HB2' HG12 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.459 HD22 ' CD1' ' A' ' 25' ' ' LEU . 11.4 p30 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.559 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.785 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.488 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.49 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.792 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.792 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.629 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.753 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.418 HD13 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.72 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.72 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.488 HG12 HG11 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.629 ' HB3' HE22 ' A' ' 40' ' ' GLN . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.546 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.753 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.8 HD21 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.656 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? -74.7 -14.53 60.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.546 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.1 mmm180 -83.31 6.08 21.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.527 168.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.633 HD23 HG22 ' A' ' 14' ' ' VAL . 29.5 tp -112.28 -56.99 2.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.295 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.866 ' HB1' ' HB ' ' A' ' 63' ' ' VAL . . . -90.41 136.91 32.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.058 174.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.587 ' HB2' ' HG3' ' A' ' 10' ' ' GLN . 0.2 OUTLIER -75.39 57.18 0.89 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.289 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.6 46.71 82.99 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.98 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -131.76 -129.94 3.09 Favored Glycine 0 N--CA 1.434 -1.449 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.048 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 7.0 tt0 -76.6 75.51 3.29 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.805 0.812 . . . . 0.0 110.016 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.866 ' HB ' ' HB1' ' A' ' 58' ' ' ALA . 2.6 p -101.01 103.26 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.974 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.511 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 2.6 t-20 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.423 HD12 ' HE2' ' A' ' 67' ' ' MET . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.423 ' HE2' HD12 ' A' ' 65' ' ' LEU . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.518 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.59 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.518 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.402 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.541 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.669 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.659 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 4.9 t -135.48 -46.58 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 1.034 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 65.9 mttm -70.51 -62.67 1.99 Allowed Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -157.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.72 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 50.5 Cg_exo -58.46 -9.1 6.26 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 123.188 2.592 . . . . 0.0 113.836 -177.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.659 ' HE2' ' HA ' ' A' ' 76' ' ' VAL . 48.9 mtmt -73.22 -50.41 22.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.067 0.461 . . . . 0.0 110.595 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 174.61 26.82 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.084 -0.806 . . . . 0.0 111.084 -174.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.609 ' HB3' ' HA ' ' A' ' 77' ' ' LYS . . . -124.53 -178.78 4.24 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -116.25 167.53 10.93 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.597 0.713 . . . . 0.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 1.034 ' HA ' ' HD3' ' A' ' 77' ' ' LYS . 1.4 mtpm? -82.69 -26.12 32.36 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.835 -167.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 67.07 -60.25 0.37 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.243 0.965 . . . . 0.0 110.728 -174.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 55.4 t80 69.45 112.46 0.05 OUTLIER 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.493 0.717 . . . . 0.0 111.545 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.1 p 54.91 85.67 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.522 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 163.29 -142.46 7.88 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 119.9 -1.143 . . . . 0.0 113.605 175.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -49.33 125.58 11.29 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.814 0.846 . . . . 0.0 112.808 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.03 -25.73 17.64 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.804 176.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -97.58 151.5 20.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.812 0.339 . . . . 0.0 110.953 -177.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 95' ' ' THR . 78.4 tttt -73.21 -45.87 53.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.289 175.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 32.1 tp 68.1 4.23 4.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.257 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' H ' ' HG2' ' A' ' 91' ' ' LYS . . . 85.85 -13.81 55.0 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.987 -0.552 . . . . 0.0 112.003 -176.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 18.8 m -85.23 -51.64 6.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.164 -177.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.685 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 62.2 m -99.71 99.41 10.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.122 0.486 . . . . 0.0 111.442 -175.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -89.6 114.45 60.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.832 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.625 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 79.2 Cg_endo -79.04 51.53 3.9 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 122.68 2.253 . . . . 0.0 112.175 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 57.12 -92.17 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.128 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.94 15.59 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.483 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.625 ' HB2' ' HB2' ' A' ' 97' ' ' PRO . 30.6 mt -67.07 -69.42 0.31 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.089 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.448 ' C ' ' HG1' ' A' ' 102' ' ' THR . 11.7 m -82.91 -107.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 171.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.501 ' C ' ' HZ3' ' A' ' 91' ' ' LYS . 3.3 m . . . . . 0 C--O 1.246 0.911 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 172.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -76.58 65.29 2.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.612 -177.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' HG3' ' HG3' ' A' ' 4' ' ' LYS . 10.2 pt-20 -95.32 -18.85 20.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.307 0.575 . . . . 0.0 109.608 173.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG3' ' HG3' ' A' ' 3' ' ' GLU . 64.0 mttm -102.3 89.43 3.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.931 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -139.44 -72.67 0.38 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.475 ' HG3' ' H ' ' A' ' 8' ' ' SER . 23.5 tp60 64.33 114.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 124.048 0.842 . . . . 0.0 111.609 177.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -76.39 18.27 0.32 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.626 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.475 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.9 m -94.89 -20.22 19.6 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 169.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -91.26 52.85 2.19 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.736 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -108.12 51.85 0.73 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.429 ' CB ' ' HB3' ' A' ' 62' ' ' GLN . 5.6 p-10 -49.04 142.86 6.23 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.229 175.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.537 ' CG2' ' HB3' ' A' ' 58' ' ' ALA . 22.3 m -124.49 133.36 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-O 121.6 0.714 . . . . 0.0 109.802 174.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.522 ' HE1' ' HA ' ' A' ' 94' ' ' SER . 15.5 t-80 -104.77 100.89 10.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 171.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.512 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m -103.5 122.29 55.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 -173.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.67 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.838 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.468 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.494 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.911 ' HB2' HD22 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.531 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.67 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.838 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.646 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.494 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.651 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.651 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.565 ' CE1' HD12 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.432 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.554 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? -66.67 -34.33 77.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 31.1 mmt180 -86.57 33.74 0.64 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.225 0.536 . . . . 0.0 110.14 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.8 tt -139.19 -60.21 0.57 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 174.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.548 ' HB2' HG11 ' A' ' 63' ' ' VAL . . . -63.06 164.7 8.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.15 166.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.93 27.95 0.37 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.603 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 66.23 20.9 69.71 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.616 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.06 -120.12 4.12 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.034 -1.079 . . . . 0.0 111.181 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.429 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 28.6 tt0 -65.98 83.86 0.08 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.483 0.659 . . . . 0.0 110.778 172.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.548 HG11 ' HB2' ' A' ' 58' ' ' ALA . 5.2 m -92.14 101.22 12.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.86 HD13 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.468 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.413 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.62 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.62 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.666 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m -89.88 84.95 2.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.502 ' HG3' ' H ' ' A' ' 80' ' ' GLY . 5.7 ptpt -83.13 155.4 67.12 Favored Pre-proline 0 C--N 1.313 -0.993 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.352 -174.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -66.07 -40.33 16.19 Favored 'Trans proline' 0 CA--C 1.52 -0.184 0 C-N-CA 122.887 2.391 . . . . 0.0 110.788 172.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -52.13 -72.53 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.062 -1.426 . . . . 0.0 113.157 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.502 ' H ' ' HG3' ' A' ' 77' ' ' LYS . . . -100.72 -23.16 10.26 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.685 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . 0.499 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -87.49 -48.94 7.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.353 0.576 . . . . 0.0 110.18 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 66.24 15.91 10.25 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.71 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -138.82 72.32 1.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.587 0.708 . . . . 0.0 111.103 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.29 71.19 10.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -89.48 28.75 1.22 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.837 -169.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.0 t -156.35 151.46 26.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.926 -0.484 . . . . 0.0 111.245 -177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.521 ' HA3' ' CD ' ' A' ' 90' ' ' GLN . . . 106.02 91.85 2.24 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.773 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -72.93 -60.54 2.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.673 0.273 . . . . 0.0 111.29 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.34 42.81 2.21 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.072 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.521 ' CD ' ' HA3' ' A' ' 87' ' ' GLY . 36.9 mt-30 -123.39 -16.44 6.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.896 0.379 . . . . 0.0 110.154 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.68 -79.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.674 -176.431 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' A' ' 92' ' ' LEU . 3.5 mm? 57.65 -91.12 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 122.774 0.429 . . . . 0.0 111.779 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -108.14 -7.17 31.16 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.263 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.522 ' HA ' ' HE1' ' A' ' 13' ' ' HIS . 13.9 t -65.53 -26.62 67.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.79 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 p -105.4 19.65 20.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.73 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.98 105.72 46.99 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.512 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -73.68 -18.11 22.57 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.078 2.519 . . . . 0.0 112.876 -176.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -139.86 121.19 14.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.583 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 14.8 p -83.66 -20.44 9.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.722 173.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.88 -50.86 25.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.32 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.7 m -114.82 106.41 14.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.885 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.616 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 p 46.25 37.98 4.59 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.665 0.786 . . . . 0.0 111.768 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.22 140.77 58.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.913 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HE3' ' HB3' ' A' ' 4' ' ' LYS . 18.7 mtpp -72.39 93.72 1.56 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.708 0.766 . . . . 0.0 111.198 -174.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -133.95 -60.69 0.81 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.523 -1.217 . . . . 0.0 108.047 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 46.16 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.472 1.108 . . . . 0.0 113.949 168.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.445 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 73.0 m-70 -96.36 13.05 29.02 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -171.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.8 m -78.73 60.01 2.67 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.799 ' HB2' ' H ' ' A' ' 60' ' ' GLY . 3.9 m -100.75 -16.95 17.16 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.539 -173.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.747 ' HA ' ' HB2' ' A' ' 58' ' ' ALA . 9.5 mt-30 85.6 44.49 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 167.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.546 ' C ' ' HB1' ' A' ' 58' ' ' ALA . 7.7 t70 -110.36 116.72 31.95 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.6 1.091 . . . . 0.0 111.339 171.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.422 HG12 ' HA ' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -154.34 143.66 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 O-C-N 123.578 0.549 . . . . 0.0 110.812 177.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -103.25 99.61 9.47 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 167.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 32.0 t -106.22 103.71 15.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 -172.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.88 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.469 ' HD2' ' HD2' ' A' ' 77' ' ' LYS . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.448 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.923 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 74' ' ' ASP . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.583 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.88 ' HB2' HD22 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.517 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.615 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.923 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.765 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.447 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.583 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.67 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.765 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.707 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.8 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.655 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.655 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.707 ' HB3' HE22 ' A' ' 40' ' ' GLN . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 56' ' ' ARG . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.8 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.406 ' N ' HD21 ' A' ' 54' ' ' LEU . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.688 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -66.49 -39.53 88.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 52' ' ' ALA . 41.3 mmt180 -85.29 24.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.145 -0.347 . . . . 0.0 111.467 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -139.53 -42.72 0.45 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.747 ' HB2' ' HA ' ' A' ' 10' ' ' GLN . . . -52.19 142.48 16.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.35 -1.295 . . . . 0.0 113.107 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.479 ' C ' ' HB3' ' A' ' 11' ' ' ASP . 7.4 p80 -141.51 106.53 4.95 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.271 0.558 . . . . 0.0 112.243 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.799 ' H ' ' HB2' ' A' ' 9' ' ' SER . . . 151.39 -41.65 0.75 Allowed Glycine 0 C--N 1.331 0.255 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -178.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.467 ' H ' ' N ' ' A' ' 11' ' ' ASP . . . 107.19 18.6 10.23 Favored Glycine 0 CA--C 1.512 -0.142 0 N-CA-C 114.287 0.475 . . . . 0.0 114.287 174.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.535 ' HB3' ' OD1' ' A' ' 11' ' ' ASP . 7.9 tt0 -114.05 75.18 0.91 Allowed 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 169.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p -91.56 102.81 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 -177.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.566 HD12 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.566 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.459 ' CD ' ' HZ3' ' A' ' 17' ' ' LYS . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.448 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.448 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 20' ' ' LYS . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.728 ' CZ ' ' HD2' ' A' ' 78' ' ' PRO . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.575 HG22 ' HD2' ' A' ' 82' ' ' PHE . 7.2 p -165.42 80.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.657 ' HB2' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -146.05 -79.94 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 168.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.728 ' HD2' ' CZ ' ' A' ' 75' ' ' PHE . 55.8 Cg_exo -56.8 -35.82 98.29 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.069 2.512 . . . . 0.0 112.606 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -34.69 -56.44 0.54 Allowed 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.433 1.083 . . . . 0.0 112.337 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -179.1 38.2 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 66.73 -78.53 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.67 . . . . 0.0 110.569 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.575 ' HD2' HG22 ' A' ' 76' ' ' VAL . 12.5 m-85 57.51 -92.73 0.04 OUTLIER 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.362 0.665 . . . . 0.0 110.175 -176.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -97.08 -74.18 0.58 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.453 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.3 -80.38 0.02 OUTLIER 'General case' 0 C--O 1.233 0.229 0 O-C-N 124.026 0.828 . . . . 0.0 109.608 -169.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -166.36 116.97 0.97 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.6 p -103.18 -17.38 15.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.2 -173.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 133.7 25.91 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.428 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 0.5 OUTLIER -93.58 123.02 36.62 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.514 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -57.69 116.45 8.17 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.742 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -68.99 120.62 15.15 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 25.3 tptp 67.87 21.38 9.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.621 0.724 . . . . 0.0 110.562 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 41.8 tp -87.71 63.74 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 0.0 109.526 176.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 89.96 130.59 4.25 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.942 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -68.22 115.2 7.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.003 0.43 . . . . 0.0 110.947 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.1 p -80.33 74.01 7.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.765 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.71 90.46 48.24 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.552 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.678 ' HG2' ' HB3' ' A' ' 100' ' ' LEU . 59.6 Cg_endo -74.18 91.04 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.354 2.036 . . . . 0.0 111.523 173.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 70.0 -80.48 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.275 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -135.82 18.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.442 . . . . 0.0 111.391 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.731 ' HG ' ' H ' ' A' ' 101' ' ' SER . 12.6 tp -122.08 -176.48 3.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.216 -178.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.731 ' H ' ' HG ' ' A' ' 100' ' ' LEU . 69.4 m -130.25 103.98 7.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.717 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.405 ' HB ' ' O ' ' A' ' 101' ' ' SER . 12.6 t . . . . . 0 C--O 1.248 1.004 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t 66.73 36.39 4.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.56 0.695 . . . . 0.0 110.218 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -163.98 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.582 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -138.31 43.92 2.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 111.003 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -131.15 -68.33 0.67 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.249 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -144.22 110.32 5.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.375 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -85.21 31.1 0.57 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.819 0.342 . . . . 0.0 111.143 -173.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.1 m -87.88 38.4 0.84 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.731 0.3 . . . . 0.0 111.082 -176.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -153.09 41.99 0.58 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.2 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -77.45 -43.05 33.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.546 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 6.3 m-20 52.2 88.78 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.057 0.848 . . . . 0.0 112.051 174.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.67 HG22 ' HA ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -66.2 111.9 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 CA-C-O 121.552 0.691 . . . . 0.0 112.102 -175.213 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -101.11 101.91 12.75 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 162.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.625 HG23 HD22 ' A' ' 54' ' ' LEU . 36.0 t -103.16 108.74 25.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.779 -166.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.73 HD22 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HD2' ' HB2' ' A' ' 77' ' ' LYS . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.682 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.426 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.542 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.73 ' HB2' HD22 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.682 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.442 HD21 HD22 ' A' ' 27' ' ' ASN . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.567 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.442 HD22 HD21 ' A' ' 25' ' ' LEU . 1.2 p-10 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.502 ' CD2' ' HB2' ' A' ' 75' ' ' PHE . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.434 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.542 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.773 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.773 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.6 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.539 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.539 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.554 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.693 HG12 HD13 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.6 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.693 HD13 HG12 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.581 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -73.08 -45.0 59.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' A' ' 56' ' ' ARG . 14.4 mmt180 -85.75 38.0 0.73 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.214 0.53 . . . . 0.0 110.168 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.43 -59.27 0.77 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.596 ' HB3' HG11 ' A' ' 12' ' ' VAL . . . -75.34 139.94 42.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.471 174.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -98.51 129.79 45.09 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.273 172.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 140.25 -42.29 1.22 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.649 -177.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 114.72 -29.25 7.62 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.203 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.546 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -60.38 118.33 6.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.451 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.67 ' HA ' HG22 ' A' ' 12' ' ' VAL . 6.5 m -131.18 104.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.598 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.421 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.534 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.641 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.473 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.437 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.641 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.74 ' CE2' ' HE2' ' A' ' 79' ' ' LYS . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.6 p -146.59 86.26 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.847 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -131.33 -55.05 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.228 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.847 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 2.8 Cg_exo -82.52 -127.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.965 3.11 . . . . 0.0 110.094 170.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.74 ' HE2' ' CE2' ' A' ' 75' ' ' PHE . 73.7 mmtt 64.16 -80.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.864 0.466 . . . . 0.0 112.104 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 154.16 -85.15 0.14 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -177.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.38 155.44 40.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -90.03 102.11 14.82 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.327 -173.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.472 ' HD3' ' O ' ' A' ' 75' ' ' PHE . 20.8 ptmt -90.95 19.84 5.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.335 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.412 ' HA ' ' HG3' ' A' ' 73' ' ' GLU . . . -56.16 111.81 1.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.294 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.7 ' HE2' ' HG2' ' A' ' 88' ' ' GLU . 52.0 t80 -94.54 -84.55 0.32 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.001 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 97.1 m 69.81 137.3 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.291 0.567 . . . . 0.0 111.161 -173.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 128.71 6.89 4.43 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.595 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.7 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 8.5 mm-40 -120.15 1.97 10.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.798 0.333 . . . . 0.0 111.399 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -159.7 -47.32 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.27 -0.966 . . . . 0.0 113.033 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -80.8 -1.48 43.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.94 0.4 . . . . 0.0 111.062 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.524 ' HZ1' ' HB2' ' A' ' 91' ' ' LYS . 0.3 OUTLIER -71.57 -33.15 68.83 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 169.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.412 HD21 ' HA ' ' A' ' 92' ' ' LEU . 13.7 mt 59.83 -74.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 168.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.66 -150.49 5.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.164 -0.541 . . . . 0.0 112.558 -178.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 p 50.55 62.76 2.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.403 0.621 . . . . 0.0 111.222 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.5 p -130.24 173.82 10.42 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.503 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -104.29 104.23 43.21 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.727 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.29 -21.27 15.5 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.752 2.301 . . . . 0.0 112.559 -178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -145.86 -159.81 1.06 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.516 HG22 HD12 ' A' ' 100' ' ' LEU . 18.3 m -61.36 -24.03 32.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.781 0.324 . . . . 0.0 111.16 175.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.516 HD12 HG22 ' A' ' 99' ' ' VAL . 11.1 mp -93.3 135.8 34.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.9 p -85.75 23.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -170.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.245 178.392 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 112.124 -0.39 . . . . 0.0 112.124 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 34.53 16.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.394 0.616 . . . . 0.0 110.123 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.39 124.58 13.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.332 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HB3' ' HZ2' ' A' ' 4' ' ' LYS . 1.8 mmmp? -74.09 88.64 1.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -75.82 162.3 28.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.851 0.834 . . . . 0.0 112.487 -172.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.22 -167.73 2.91 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.263 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -87.3 48.27 1.62 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.432 0.634 . . . . 0.0 110.059 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.7 p -96.07 4.03 52.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.046 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 m -81.74 53.88 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.181 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -94.24 22.05 6.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.645 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 63.0 174.29 0.15 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.27 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.915 ' HB ' ' HA ' ' A' ' 63' ' ' VAL . 2.2 t -123.29 102.33 11.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.436 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -112.46 103.08 11.16 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 172.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.546 HG21 HD11 ' A' ' 54' ' ' LEU . 1.9 m -115.47 113.57 43.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 -173.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.513 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.501 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.425 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.721 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.862 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.617 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.617 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.579 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.597 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.512 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.634 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.541 ' HB3' HG13 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.634 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.862 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.579 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.597 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.521 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.456 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.583 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.843 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.421 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.421 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.711 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.588 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.843 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.588 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.564 ' HD3' ' HA3' ' A' ' 60' ' ' GLY . 2.5 tmt_? -67.93 -55.32 13.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -86.02 38.62 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.163 0.506 . . . . 0.0 111.025 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.633 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 1.5 tm? -117.93 -52.52 2.42 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.458 ' CB ' HG21 ' A' ' 12' ' ' VAL . . . -84.03 -174.11 5.1 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.179 -1.373 . . . . 0.0 109.69 166.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -62.97 -23.32 67.36 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.069 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.564 ' HA3' ' HD3' ' A' ' 55' ' ' ARG . . . 89.46 27.67 21.85 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.353 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.99 -102.22 0.33 Allowed Glycine 0 CA--C 1.506 -0.523 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.646 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -76.48 87.08 3.21 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 115.221 -0.489 . . . . 0.0 109.952 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.915 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.2 t -89.67 102.54 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.479 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.721 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.508 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.422 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.508 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.659 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 76' ' ' VAL . 7.0 p -173.13 96.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.795 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.8 OUTLIER -141.02 -62.62 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.678 169.69 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.795 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 25.8 Cg_exo -66.58 -42.55 9.23 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 122.757 2.305 . . . . 0.0 111.362 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -65.93 -4.34 6.81 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.708 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -135.06 39.83 1.64 Allowed Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 177.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 65.14 -79.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.665 0.786 . . . . 0.0 111.076 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.42 -5.48 0.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.768 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm 50.59 93.27 0.02 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.928 -171.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -49.79 133.64 21.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 170.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -72.17 64.35 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.842 0.83 . . . . 0.0 112.577 -167.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -149.67 76.0 1.29 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.31 101.07 1.96 Allowed Glycine 0 N--CA 1.443 -0.898 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.581 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.13 -41.41 79.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -100.95 47.88 1.18 Allowed Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -129.68 -75.52 0.55 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.175 -178.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -108.2 -13.2 14.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.401 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.4 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 27.6 tp 64.49 28.68 13.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.932 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.34 1.73 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.625 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m -86.45 -20.39 28.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.877 0.37 . . . . 0.0 110.614 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.0 m -108.88 84.81 1.99 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.2 0.524 . . . . 0.0 110.225 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -162.79 86.94 1.37 Allowed Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.846 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -62.86 -72.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.764 2.309 . . . . 0.0 112.523 -178.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -176.57 -89.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.41 ' HB ' ' H ' ' A' ' 100' ' ' LEU . 13.2 t 49.83 -96.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 123.613 0.765 . . . . 0.0 112.284 176.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.41 ' H ' ' HB ' ' A' ' 99' ' ' VAL . 12.8 tp -168.42 -67.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.6 m -99.13 -178.41 3.92 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.016 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.331 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 t -142.42 149.23 39.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.055 0.455 . . . . 0.0 110.594 -176.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -100.08 -13.15 19.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.023 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt 55.03 73.57 0.41 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.722 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -101.38 169.78 8.66 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.889 -176.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -125.93 -63.84 1.09 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -157.67 -37.97 0.07 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.129 174.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 64.3 m 65.48 3.12 2.24 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 170.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 m -140.3 39.72 1.91 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.216 0.531 . . . . 0.0 110.644 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -87.26 -24.33 24.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.501 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 p30 55.74 161.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.608 1.163 . . . . 0.0 113.536 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.655 HG21 ' HA ' ' A' ' 63' ' ' VAL . 0.0 OUTLIER -116.56 112.26 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.441 169.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -103.89 101.37 11.17 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.779 HG13 HD22 ' A' ' 54' ' ' LEU . 13.1 m -108.04 106.45 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 -172.411 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.768 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.598 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.813 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.541 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.768 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.405 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.646 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.688 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.467 ' OD1' HD13 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.813 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.541 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.469 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.401 HE21 ' HB2' ' A' ' 34' ' ' GLN . 15.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.47 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.625 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.443 HD13 HD11 ' A' ' 16' ' ' LEU . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.625 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.717 HG21 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.634 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.779 HD22 HG13 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 tpp180 -62.48 -56.29 19.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.9 tpt180 -82.76 50.76 1.75 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.868 0.842 . . . . 0.0 110.248 174.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 40.9 tp -141.92 -57.62 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.565 169.221 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.588 ' HB2' HG12 ' A' ' 12' ' ' VAL . . . -63.93 142.73 58.3 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.757 175.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -94.57 99.43 11.58 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 152.5 -40.65 0.72 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.096 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.15 -1.57 67.64 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.741 . . . . 0.0 113.201 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -79.84 115.09 19.24 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.717 HG11 HG21 ' A' ' 50' ' ' VAL . 54.5 t -122.83 115.26 45.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.518 -174.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.433 HD11 HD11 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.447 ' HE2' HD13 ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.598 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.68 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.623 ' HB2' HD11 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 84' ' ' ALA . 7.3 p -163.89 120.26 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.727 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 28.1 ttmt -173.33 -70.81 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.432 170.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.727 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 32.2 Cg_exo -62.64 -40.03 40.12 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.307 2.004 . . . . 0.0 109.9 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.417 ' HG3' ' O ' ' A' ' 79' ' ' LYS . 13.9 ptmm? -97.61 74.01 2.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.461 -1.245 . . . . 0.0 110.2 172.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -140.3 -169.57 11.74 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.678 -0.773 . . . . 0.0 111.508 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -89.66 -60.48 1.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -154.5 -63.52 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.155 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -105.71 103.24 12.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.525 0.678 . . . . 0.0 110.314 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.404 ' HB3' HG12 ' A' ' 76' ' ' VAL . . . -84.41 50.74 1.94 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.617 -175.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -174.28 136.94 0.5 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.101 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.8 m -92.0 -29.12 16.78 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.44 -57.39 5.03 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.802 176.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -77.31 147.86 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.029 0.442 . . . . 0.0 111.627 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.2 -0.48 56.0 Favored Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.822 -0.626 . . . . 0.0 113.755 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -118.65 -44.7 2.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.508 0.654 . . . . 0.0 111.583 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -108.04 -17.67 13.98 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 71.65 -50.99 0.69 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.775 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 130.41 130.39 3.2 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.346 174.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 p -105.02 34.82 3.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.624 0.726 . . . . 0.0 109.358 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.0 p -76.2 -47.41 24.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.799 -1.092 . . . . 0.0 112.443 -172.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.46 117.18 68.21 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.904 -173.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.59 126.82 13.16 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 123.039 2.492 . . . . 0.0 110.986 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 63.86 -78.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.292 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 13.5 p -155.84 -26.18 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.921 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.6 tp -82.49 160.46 22.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.624 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -63.7 -49.96 71.09 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.261 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.266 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.309 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.594 -0.602 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -155.66 121.55 5.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.875 0.369 . . . . 0.0 110.859 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -96.44 -3.92 42.59 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 tttt 64.51 37.54 7.97 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.442 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.401 ' O ' ' HB3' ' A' ' 6' ' ' GLN . 15.6 mmm180 -94.69 -176.95 4.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.098 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.401 ' HB3' ' O ' ' A' ' 5' ' ' ARG . 54.0 tt0 73.95 125.89 0.04 OUTLIER 'General case' 0 C--O 1.235 0.303 0 O-C-N 123.794 0.684 . . . . 0.0 110.522 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -78.57 74.34 5.1 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.633 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.541 ' O ' ' HB2' ' A' ' 62' ' ' GLN . 16.3 m -85.88 52.78 2.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.84 -172.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.1 p -104.99 22.12 15.85 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.695 0.759 . . . . 0.0 110.056 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -63.24 -35.05 79.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.977 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.858 ' HA ' ' HA ' ' A' ' 62' ' ' GLN . 19.9 t70 66.97 126.89 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.983 0.913 . . . . 0.0 112.507 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 62' ' ' GLN . 9.0 m -122.19 166.94 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.281 -178.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -112.98 122.96 49.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.02 0.438 . . . . 0.0 110.527 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.751 HG12 HD22 ' A' ' 54' ' ' LEU . 98.8 t -101.92 106.51 19.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.836 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 HD11 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.882 ' HG2' ' HD3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.471 ' HG ' ' CG ' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.761 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.631 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.572 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.568 HD22 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.4 HD22 HD12 ' A' ' 25' ' ' LEU . 9.6 p30 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.429 ' HB3' ' H ' ' A' ' 30' ' ' LEU . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.761 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.575 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.631 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.655 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.655 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.44 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.642 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.683 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.576 HD11 HD11 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.484 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.528 HG11 HG12 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.44 ' HB3' HE22 ' A' ' 40' ' ' GLN . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.504 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.642 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.751 HD22 HG12 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -66.44 -32.2 73.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 23.1 mmm180 -85.46 36.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.115 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.4 tt -147.53 -59.92 0.27 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 1.02 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -89.86 142.24 27.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.613 177.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -100.2 142.14 32.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.784 -168.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.03 -6.45 3.9 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.554 0.581 . . . . 0.0 114.554 170.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.431 ' C ' ' H ' ' A' ' 63' ' ' VAL . . . 114.63 9.63 14.14 Favored Glycine 0 CA--C 1.504 -0.636 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.642 -175.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.858 ' HA ' ' HA ' ' A' ' 11' ' ' ASP . 33.9 tt0 -67.02 43.25 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.857 0.863 . . . . 0.0 109.827 170.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 1.02 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 7.4 p -153.21 124.17 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 -172.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.641 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.471 ' CG ' ' HG ' ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.641 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.642 ' CE1' ' HD2' ' A' ' 78' ' ' PRO . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -166.46 -14.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.882 ' HD3' ' HG2' ' A' ' 17' ' ' LYS . 23.3 mtpp -83.73 -70.0 0.14 Allowed Pre-proline 0 CA--C 1.542 0.672 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -168.271 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.736 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 17.3 Cg_exo -71.77 47.39 0.94 Allowed 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.947 2.431 . . . . 0.0 113.344 175.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 79' ' ' LYS . 32.6 mtpt -115.81 -15.32 11.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.676 0.274 . . . . 0.0 111.517 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 117.71 -52.7 0.68 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.966 175.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.24 152.22 34.06 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -113.87 73.81 0.84 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.5 0.667 . . . . 0.0 111.309 -176.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -120.75 -7.3 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.777 ' HB1' ' HG2' ' A' ' 77' ' ' LYS . . . -65.93 115.74 6.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.198 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -76.78 174.46 10.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.096 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.3 t -161.28 105.89 1.32 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.293 0.568 . . . . 0.0 112.035 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.39 -77.21 1.23 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.934 170.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -76.75 72.94 3.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.152 0.501 . . . . 0.0 111.138 -175.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.32 103.09 1.9 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.891 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 15.0 mm-40 -92.74 -35.12 13.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.969 0.414 . . . . 0.0 110.047 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -168.58 103.69 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.626 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 47.8 tp -114.94 -23.5 9.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.577 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 169.68 129.02 1.06 Allowed Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.652 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.7 t -102.57 36.44 2.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.9 0.381 . . . . 0.0 110.508 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -33.04 74.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.089 0.471 . . . . 0.0 110.711 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.65 96.02 41.66 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.133 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -56.14 -56.49 2.08 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.41 2.74 . . . . 0.0 112.831 -176.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.404 ' HG3' HG13 ' A' ' 99' ' ' VAL . 5.1 tp-100 179.35 -82.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.896 0.379 . . . . 0.0 110.233 177.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.404 HG13 ' HG3' ' A' ' 98' ' ' GLN . 8.7 p -163.05 -29.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.273 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 tp -54.91 -74.98 0.04 OUTLIER 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.139 0.495 . . . . 0.0 110.694 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -94.0 57.44 2.42 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.223 0.535 . . . . 0.0 109.606 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.119 -178.291 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -120.91 -47.87 2.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.963 0.382 . . . . 0.0 109.995 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.64 ' HG3' ' H ' ' A' ' 4' ' ' LYS . 3.0 pt-20 -57.24 -46.34 83.09 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.64 ' H ' ' HG3' ' A' ' 3' ' ' GLU . 36.7 mtmm -118.3 79.83 1.44 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.845 172.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 tpp85 -51.59 -44.73 62.89 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.641 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -177.36 -74.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.461 173.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.9 t60 176.91 134.57 0.06 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.48 -1.236 . . . . 0.0 107.838 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.642 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 19.6 m 61.25 73.89 0.46 Allowed 'General case' 0 C--N 1.327 -0.371 0 O-C-N 123.706 0.629 . . . . 0.0 110.823 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 p -134.06 -2.49 2.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.873 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -96.84 4.18 51.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.415 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.8 m-20 49.43 -157.86 0.08 Allowed 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.695 0.622 . . . . 0.0 112.028 173.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.508 ' CG1' ' HA ' ' A' ' 58' ' ' ALA . 10.9 p -162.61 139.18 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.701 0.763 . . . . 0.0 112.355 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -111.88 105.07 13.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.384 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.617 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m -103.93 136.37 37.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.637 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.449 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.682 ' HE3' ' HB2' ' A' ' 77' ' ' LYS . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.534 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.859 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.469 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.65 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.537 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.637 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.421 ' HB3' HG11 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.824 ' HB3' HD12 ' A' ' 57' ' ' LEU . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.859 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.424 ' N ' HD22 ' A' ' 30' ' ' LEU . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.65 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.485 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.532 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.47 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.532 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.885 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.885 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.562 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.733 HG21 HG13 ' A' ' 63' ' ' VAL . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.492 ' HD2' HD12 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.699 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.492 HD12 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.722 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 -78.17 -32.92 50.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -77.89 -3.16 40.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.671 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.824 HD12 ' HB3' ' A' ' 27' ' ' ASN . 1.1 tt -104.34 -34.64 8.23 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 172.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.508 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . . . -57.83 120.82 9.12 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.406 1.098 . . . . 0.0 111.481 175.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.642 ' O ' ' HB3' ' A' ' 8' ' ' SER . 35.8 m80 -88.4 -70.34 0.65 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.389 -176.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.54 ' HA2' ' O ' ' A' ' 8' ' ' SER . . . -68.45 -32.83 75.85 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.385 -177.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.82 -21.46 5.59 Favored Glycine 0 CA--C 1.499 -0.946 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.415 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 6.2 tt0 -72.51 90.89 1.36 Allowed 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.002 -0.599 . . . . 0.0 109.631 171.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.733 HG13 HG21 ' A' ' 50' ' ' VAL . 3.6 p -94.81 102.67 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 174.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.617 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.448 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.413 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.534 ' HG3' ' HG ' ' A' ' 18' ' ' LEU . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.452 ' CD ' ' HZ1' ' A' ' 83' ' ' LYS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.661 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.435 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -159.84 99.85 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.844 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 17.5 ttpp -162.09 -69.82 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 163.039 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.844 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 22.4 Cg_exo -68.89 -38.92 9.06 Favored 'Trans proline' 0 N--CA 1.475 0.437 0 C-N-CA 123.074 2.516 . . . . 0.0 112.534 -175.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -49.46 -44.31 45.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.308 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -178.92 33.29 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 61.42 -79.62 0.02 OUTLIER 'General case' 0 C--O 1.235 0.338 0 O-C-N 124.171 0.571 . . . . 0.0 110.439 -172.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.79 ' HD2' ' HG2' ' A' ' 83' ' ' LYS . 16.8 t80 66.9 -70.57 0.11 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.948 0.899 . . . . 0.0 110.682 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.79 ' HG2' ' HD2' ' A' ' 82' ' ' PHE . 21.2 pttp -159.03 65.41 0.41 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.487 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.09 67.1 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -146.3 129.99 17.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.6 t -130.07 -49.27 1.11 Allowed 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.644 -174.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.8 -49.0 2.39 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.58 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -53.68 -51.2 63.97 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.051 0.54 . . . . 0.0 110.898 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -102.89 28.64 14.96 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.473 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -126.15 -66.43 0.93 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.312 0.577 . . . . 0.0 109.851 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.4 ' HD2' HG23 ' A' ' 102' ' ' THR . 25.2 ttpp -161.51 90.34 0.79 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.68 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.64 -39.65 88.34 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.51 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -139.69 -83.23 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.111 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.4 p -151.21 -62.17 0.18 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.64 0.257 . . . . 0.0 110.584 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m 60.18 55.65 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.997 0.903 . . . . 0.0 109.496 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB2' ' HA ' ' A' ' 101' ' ' SER . . . -141.07 71.87 27.87 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.674 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.6 -67.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -151.33 149.92 29.91 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.3 t 70.4 -58.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 O-C-N 123.985 0.803 . . . . 0.0 110.529 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.426 HD13 ' N ' ' A' ' 100' ' ' LEU . 5.5 mp -79.58 116.72 19.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 174.223 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.475 ' HA ' ' HB2' ' A' ' 96' ' ' ALA . 36.6 t -126.32 126.62 44.24 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.036 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.4 HG23 ' HD2' ' A' ' 91' ' ' LYS . 23.5 m . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.188 178.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.383 -0.287 . . . . 0.0 112.383 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -177.72 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.152 0.501 . . . . 0.0 109.687 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -137.11 -27.29 0.98 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.27 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.23 84.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 171.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.416 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 19.9 mmm180 -95.51 -175.83 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.098 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 62.64 -171.44 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.797 0.686 . . . . 0.0 111.236 -177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -140.49 142.1 35.31 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 173.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.481 ' HB3' HG13 ' A' ' 12' ' ' VAL . 3.1 t -51.63 120.06 4.81 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.572 0.545 . . . . 0.0 109.893 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.543 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 66.7 m -134.72 46.8 2.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.843 -171.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -143.81 52.3 1.32 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 63.77 105.01 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 O-C-N 123.734 0.646 . . . . 0.0 109.862 -176.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.481 HG13 ' HB3' ' A' ' 8' ' ' SER . 2.1 m -118.59 165.58 13.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -161.375 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -114.17 116.66 29.44 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.732 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t -104.85 151.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.899 HG12 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.625 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.899 ' HE3' HG12 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.58 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.945 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.414 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.414 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.578 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.625 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.554 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.505 HD21 ' N ' ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.603 ' HB3' ' HG ' ' A' ' 57' ' ' LEU . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.945 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.648 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.578 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.772 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.512 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.772 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.512 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.534 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.626 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.534 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -64.65 -42.06 95.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 56' ' ' ARG . 8.6 mmt180 -86.36 26.37 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.603 ' HG ' ' HB3' ' A' ' 27' ' ' ASN . 2.9 tm? -124.81 -43.74 1.98 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 174.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.402 ' HB3' HG23 ' A' ' 12' ' ' VAL . . . -79.09 136.26 37.1 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.045 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 9' ' ' SER . 2.1 t60 -107.71 138.78 43.33 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.502 173.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.1 -32.17 7.47 Favored Glycine 0 N--CA 1.445 -0.756 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -174.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.24 -24.66 24.06 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.781 176.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -75.1 95.43 3.07 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.333 0.587 . . . . 0.0 109.888 178.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p -116.51 105.15 17.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.273 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.546 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.447 ' CD ' ' HZ1' ' A' ' 77' ' ' LYS . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.58 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.434 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.543 ' OE2' ' HA ' ' A' ' 84' ' ' ALA . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.579 ' HB2' HD11 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.497 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 4.5 p -160.77 -21.95 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.672 ' HB2' ' HD3' ' A' ' 78' ' ' PRO . 6.4 mmmt -62.19 -65.17 2.31 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -170.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.672 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 72.9 Cg_exo -56.48 -36.08 97.25 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.269 2.646 . . . . 0.0 113.299 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.529 ' HE3' ' CD2' ' A' ' 75' ' ' PHE . 95.1 mttt -48.93 -59.16 3.83 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.539 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 141.06 -156.68 25.67 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.31 -43.52 0.55 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.494 0.718 . . . . 0.0 111.914 178.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 57.56 58.13 3.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 111.691 175.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -104.07 -7.17 20.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.374 172.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.543 ' HA ' ' OE2' ' A' ' 73' ' ' GLU . . . -56.81 128.18 35.37 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.929 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -87.46 82.17 7.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.252 0.549 . . . . 0.0 110.611 -174.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.3 m -80.03 82.74 6.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.066 176.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -155.61 178.66 32.09 Favored Glycine 0 N--CA 1.445 -0.767 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.438 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -86.65 -39.83 15.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.302 0.573 . . . . 0.0 110.031 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.459 ' HA2' HD12 ' A' ' 92' ' ' LEU . . . -80.44 44.58 2.92 Favored Glycine 0 C--O 1.227 -0.292 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.847 -177.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.8 136.09 33.3 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt 74.99 -42.21 0.48 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 111.699 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.459 HD12 ' HA2' ' A' ' 89' ' ' GLY . 4.5 pp -75.63 -14.36 60.37 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.308 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -136.59 132.78 6.2 Favored Glycine 0 N--CA 1.438 -1.209 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.123 172.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.4 p -164.16 -37.41 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.995 0.398 . . . . 0.0 111.153 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.2 p -67.84 -20.79 65.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.501 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.48 81.27 46.73 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.033 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.409 ' HB2' ' HA ' ' A' ' 102' ' ' THR . 46.1 Cg_exo -57.13 111.25 0.75 Allowed 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.334 2.689 . . . . 0.0 112.574 -176.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 58.63 24.45 12.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.465 178.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.9 m 40.23 36.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.197 0.999 . . . . 0.0 112.562 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -125.89 -70.32 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.631 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.9 p -152.45 -77.8 0.12 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.407 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.409 ' HA ' ' HB2' ' A' ' 97' ' ' PRO . 1.2 p . . . . . 0 C--O 1.25 1.091 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.341 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 m -74.31 124.63 26.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.863 0.363 . . . . 0.0 110.331 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.85 -3.68 45.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.182 0.515 . . . . 0.0 110.281 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -83.11 64.93 7.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.658 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 1.8 mmp_? -114.98 168.29 10.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.928 -174.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.577 ' HG3' ' H ' ' A' ' 8' ' ' SER . 8.4 tp-100 -78.98 127.93 32.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.602 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 65.4 m80 -87.01 9.8 18.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.06 -175.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.577 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.5 m 60.24 49.03 7.54 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.589 0.709 . . . . 0.0 109.63 -174.031 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.442 ' HA ' ' CD2' ' A' ' 59' ' ' HIS . 28.7 m -84.71 52.0 2.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.223 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -118.24 44.32 2.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.676 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.468 ' CB ' ' HB3' ' A' ' 62' ' ' GLN . 1.3 p30 53.64 -177.54 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.531 1.144 . . . . 0.0 112.559 175.226 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.7 p -160.83 117.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.332 168.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -107.07 121.96 45.51 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.264 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.469 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t -103.75 116.65 47.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.846 -174.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.469 HG11 ' HG2' ' A' ' 78' ' ' PRO . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.651 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.562 ' HZ3' ' CD ' ' A' ' 68' ' ' GLU . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.553 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.846 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.451 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.53 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.694 ' HB3' ' HH ' ' A' ' 33' ' ' TYR . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.651 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.478 HD11 ' N ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.469 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.445 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.9 p30 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.405 ' OE2' ' HG3' ' A' ' 79' ' ' LYS . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.846 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.51 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.53 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.694 ' HH ' ' HB3' ' A' ' 23' ' ' PHE . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.661 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.661 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.539 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.445 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.464 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.655 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? -72.5 -28.38 62.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.638 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 3.1 mmp_? -87.24 38.16 0.8 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.789 0.328 . . . . 0.0 111.279 168.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -133.28 -58.86 0.89 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.426 ' C ' ' H ' ' A' ' 60' ' ' GLY . . . -82.18 159.79 23.21 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 168.397 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.602 ' HB3' ' O ' ' A' ' 7' ' ' HIS . 1.7 p80 -71.77 34.46 0.06 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.426 ' H ' ' C ' ' A' ' 58' ' ' ALA . . . 74.68 16.14 80.36 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -172.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -117.07 156.03 15.84 Favored Glycine 0 N--CA 1.444 -0.789 0 CA-C-O 119.459 -0.634 . . . . 0.0 111.577 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.468 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 8.5 tt0 14.1 58.36 0.01 OUTLIER 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.264 1.426 . . . . 0.0 112.87 -166.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p -99.02 104.51 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.334 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.562 ' CD ' ' HZ3' ' A' ' 17' ' ' LYS . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.567 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' C ' ' H ' ' A' ' 73' ' ' GLU . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.567 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.688 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m -150.41 54.94 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.902 ' HE3' ' HD2' ' A' ' 78' ' ' PRO . 9.3 ptmt -74.02 177.78 1.95 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.902 ' HD2' ' HE3' ' A' ' 77' ' ' LYS . 30.6 Cg_exo -66.06 52.28 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.172 2.581 . . . . 0.0 112.907 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.553 ' HG2' ' CD ' ' A' ' 77' ' ' LYS . 16.3 mmtp -120.14 -64.5 1.25 Allowed 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.886 0.474 . . . . 0.0 110.393 174.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.16 38.53 3.21 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.392 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -161.64 -50.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.396 . . . . 0.0 109.997 -175.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 53.52 53.16 12.01 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.584 0.552 . . . . 0.0 110.821 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.492 ' NZ ' ' HB3' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -161.52 127.46 3.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.85 178.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -114.44 61.84 0.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.403 175.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -72.45 -23.09 61.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.309 -176.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.9 m -106.1 90.43 3.37 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.455 ' O ' ' HG3' ' A' ' 90' ' ' GLN . . . -99.3 -147.55 21.91 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.753 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -49.26 129.22 18.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 122.913 0.485 . . . . 0.0 112.269 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.94 38.37 2.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.677 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 87' ' ' GLY . 8.0 mt-30 -86.44 95.75 9.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.21 0.528 . . . . 0.0 111.295 -177.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.632 ' HB3' ' HZ1' ' A' ' 91' ' ' LYS . 8.8 mtpm? 60.53 30.6 19.88 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.126 177.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 54.6 tp -95.42 81.73 3.61 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 151.97 -173.67 31.14 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.999 -0.62 . . . . 0.0 111.898 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 68.6 m 67.45 5.97 4.64 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.239 0.615 . . . . 0.0 112.397 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 39.4 m 60.4 95.98 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.726 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.65 85.69 44.24 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.34 -64.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.777 2.318 . . . . 0.0 111.859 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -137.3 117.76 13.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.015 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.69 78.04 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.383 1.087 . . . . 0.0 110.298 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.1 tt -162.77 -63.92 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.483 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.6 m -78.61 -57.07 3.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.796 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.661 -179.779 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.551 ' HB2' ' HB2' ' A' ' 5' ' ' ARG . 19.4 m -97.85 7.31 46.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.851 0.358 . . . . 0.0 110.385 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 70.54 -76.42 0.06 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.584 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -96.78 33.02 1.94 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.48 0.181 . . . . 0.0 111.062 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.551 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 42.0 ttm180 -61.82 -57.73 10.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.855 0.359 . . . . 0.0 111.124 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -91.56 118.95 31.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.311 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -147.72 -171.37 3.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.055 -179.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 1.035 ' HA ' ' HA ' ' A' ' 58' ' ' ALA . 36.4 m 73.68 -57.19 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.816 0.698 . . . . 0.0 111.62 176.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 p -111.48 -7.19 14.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.999 0.428 . . . . 0.0 110.744 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 29.1 mt-30 -133.38 56.81 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.444 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.563 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 4.4 t70 75.78 151.58 0.12 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 124.111 0.882 . . . . 0.0 111.997 174.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.54 HG22 HD12 ' A' ' 57' ' ' LEU . 14.7 p -153.77 122.5 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.029 171.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -104.53 114.95 29.51 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.694 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t -101.45 125.6 55.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 -172.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.516 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.534 ' HZ2' ' CD ' ' A' ' 68' ' ' GLU . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.605 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.869 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.794 ' HB2' ' HD2' ' A' ' 77' ' ' LYS . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.59 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.438 HD22 ' CD2' ' A' ' 54' ' ' LEU . 2.1 m-80 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.869 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.725 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.517 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.658 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.725 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.551 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.732 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.732 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.517 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.525 ' HD2' HD13 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.537 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.694 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.73 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -76.76 -15.05 59.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.537 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.4 mmm180 -85.03 1.48 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 109.933 168.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.54 HD12 HG22 ' A' ' 12' ' ' VAL . 1.3 tm? -102.83 -57.87 1.97 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 173.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 1.035 ' HA ' ' HA ' ' A' ' 8' ' ' SER . . . -96.55 132.85 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.977 173.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.58 70.33 3.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.676 -170.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 60.84 43.84 98.76 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.91 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.21 -147.99 9.69 Favored Glycine 0 N--CA 1.437 -1.254 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.563 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 8.8 tt0 -71.02 77.59 0.66 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.494 0.664 . . . . 0.0 109.511 170.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.91 HG23 ' HB2' ' A' ' 58' ' ' ALA . 13.8 t -95.94 103.98 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.791 -177.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.605 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.538 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.569 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.538 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.665 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.408 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m -141.51 77.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.794 ' HD2' ' HB2' ' A' ' 24' ' ' SER . 9.6 mtpt -77.14 166.93 40.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 O-C-N 121.968 -0.458 . . . . 0.0 111.644 -175.19 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.535 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 38.7 Cg_exo -63.98 -11.98 29.88 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.386 2.724 . . . . 0.0 111.953 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.638 ' HG2' ' HB3' ' A' ' 77' ' ' LYS . 12.1 ptmm? -86.53 5.13 36.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.768 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -148.35 35.22 1.15 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.294 179.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -153.37 -85.31 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.477 0.18 . . . . 0.0 111.18 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -178.93 137.75 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.535 ' O ' ' HB3' ' A' ' 78' ' ' PRO . 29.5 mmtp 42.22 -93.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -175.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 171.02 -36.9 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.104 -174.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -74.07 143.86 45.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.895 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.4 m -61.28 106.19 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.454 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -93.5 86.06 1.12 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.428 -0.669 . . . . 0.0 111.428 176.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 73.17 -50.14 0.7 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.579 0.752 . . . . 0.0 110.556 -175.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -137.8 168.44 24.51 Favored Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 175.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -74.56 -76.8 0.13 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.091 0.446 . . . . 0.0 109.991 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 59.4 tttm -160.21 51.93 0.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.823 0.821 . . . . 0.0 109.367 171.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -99.37 -0.91 40.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.004 179.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.94 115.85 2.31 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.225 -178.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 9.8 p -86.13 43.71 1.08 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.334 0.588 . . . . 0.0 110.768 178.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -86.14 61.89 7.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.884 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 52.69 78.93 0.37 Allowed Pre-proline 0 C--O 1.236 0.364 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.159 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 98' ' ' GLN . 4.6 Cg_exo -74.39 117.8 5.11 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.918 2.412 . . . . 0.0 111.717 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 97' ' ' PRO . 24.0 mt-30 67.96 -172.01 0.19 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.583 0.552 . . . . 0.0 110.548 -178.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.76 15.75 8.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.903 0.859 . . . . 0.0 109.861 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.41 HD12 ' HB3' ' A' ' 98' ' ' GLN . 9.4 mp -82.69 117.58 22.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.151 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.9 p 48.62 41.42 17.48 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.114 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.319 -177.837 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -129.81 36.45 4.06 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.977 0.418 . . . . 0.0 110.442 -176.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -131.11 -81.28 0.53 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.843 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.38 91.72 3.88 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -95.2 -90.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.292 -174.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -124.72 137.23 54.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.933 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -111.15 61.89 0.61 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.585 0.707 . . . . 0.0 110.385 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -100.52 21.11 13.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.247 173.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -65.36 -49.33 69.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.621 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 47.79 40.81 13.12 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -71.08 106.86 3.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.121 174.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.25 154.86 18.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.432 0.634 . . . . 0.0 112.311 -166.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.476 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 28.5 m170 -112.72 133.41 54.75 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 175.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 54' ' ' LEU . 33.1 t -103.21 150.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 1.054 HG12 ' HG3' ' A' ' 78' ' ' PRO . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.959 HD22 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.718 ' HE3' ' HD3' ' A' ' 78' ' ' PRO . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.588 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.594 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.594 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.959 ' HB2' HD22 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.652 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.624 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.516 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.634 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.65 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.65 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.545 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.652 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.652 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.585 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.545 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.585 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 -67.12 -36.49 82.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.474 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 5.7 mmp_? -85.34 41.1 0.87 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.457 0.646 . . . . 0.0 109.901 171.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.3 tt -148.22 -54.19 0.2 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.698 ' HB1' ' HB ' ' A' ' 63' ' ' VAL . . . -93.55 149.21 21.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.11 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -118.94 -166.15 1.21 Allowed 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 174.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.34 -65.98 2.66 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.235 -0.983 . . . . 0.0 111.564 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 145.89 -28.75 1.72 Allowed Glycine 0 CA--C 1.495 -1.202 0 C-N-CA 120.621 -0.799 . . . . 0.0 113.882 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -79.0 55.89 1.86 Allowed 'General case' 0 N--CA 1.44 -0.972 0 CA-C-O 121.264 0.554 . . . . 0.0 110.821 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.698 ' HB ' ' HB1' ' A' ' 58' ' ' ALA . 2.6 p -90.31 102.05 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 1.7 t-20 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.569 HD13 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.496 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.495 ' O ' ' HA ' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.588 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.571 ' CG ' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.624 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.562 HG11 ' O ' ' A' ' 76' ' ' VAL . 9.2 p -134.15 94.79 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.599 ' HG3' ' HG3' ' A' ' 79' ' ' LYS . 5.5 ptpt -88.68 163.04 37.1 Favored Pre-proline 0 C--N 1.313 -1.022 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.598 -167.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 1.054 ' HG3' HG12 ' A' ' 15' ' ' VAL . 63.9 Cg_endo -77.31 -19.93 12.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.525 2.15 . . . . 0.0 110.781 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.599 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 10.9 ptpt -86.59 79.75 8.81 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.86 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 138.64 -62.91 0.56 Allowed Glycine 0 N--CA 1.445 -0.728 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.791 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.75 8.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.737 0.303 . . . . 0.0 110.597 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.6 t80 71.11 -9.76 0.83 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -64.33 -27.76 69.24 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 62.02 -165.54 0.23 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.394 0.434 . . . . 0.0 111.89 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -167.11 120.31 0.97 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.642 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 90' ' ' GLN . 20.8 p -90.36 -62.52 1.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.173 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.405 ' C ' ' H ' ' A' ' 89' ' ' GLY . . . 59.0 71.07 0.82 Allowed Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.861 176.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 72.47 -42.93 0.55 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.423 0.689 . . . . 0.0 111.546 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 87' ' ' GLY . . . 168.4 -39.01 0.22 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -179.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 86' ' ' THR . 6.9 tt0 56.42 65.04 1.51 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.529 0.681 . . . . 0.0 111.399 172.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.522 ' HZ3' ' HB3' ' A' ' 91' ' ' LYS . 0.1 OUTLIER -168.0 -45.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.036 172.656 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.3 mt 46.48 48.01 14.0 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.926 0.766 . . . . 0.0 112.056 171.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -176.42 -129.33 1.22 Allowed Glycine 0 N--CA 1.443 -0.848 0 C-N-CA 120.682 -0.771 . . . . 0.0 111.886 -178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.5 m 57.0 42.0 26.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.602 0.715 . . . . 0.0 109.887 -177.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -75.02 111.57 10.38 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.363 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.472 ' N ' ' HD3' ' A' ' 97' ' ' PRO . . . -141.82 59.18 9.24 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.324 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.806 ' HD2' HG23 ' A' ' 102' ' ' THR . 93.2 Cg_endo -91.66 -158.75 0.07 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.026 2.484 . . . . 0.0 111.645 -177.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -119.8 83.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.39 0.614 . . . . 0.0 110.716 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.3 t -87.38 -57.91 3.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 171.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 14.3 tp -175.62 -73.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.937 -1.028 . . . . 0.0 108.6 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 p -99.89 83.71 2.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.905 175.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . 0.806 HG23 ' HD2' ' A' ' 97' ' ' PRO . 7.9 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.448 -175.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.957 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -137.6 122.76 19.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.42 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 pt-20 -172.88 -41.89 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.713 ' HB3' ' HB3' ' A' ' 7' ' ' HIS . 65.3 mmtt -92.72 112.87 24.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 174.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -44.75 -70.85 0.09 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.037 0.835 . . . . 0.0 112.682 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -106.85 -6.07 17.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 109.749 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.713 ' HB3' ' HB3' ' A' ' 4' ' ' LYS . 6.5 t-160 -87.55 32.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.862 178.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -76.55 63.7 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.733 0.778 . . . . 0.0 109.409 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.585 ' HA ' ' CD2' ' A' ' 59' ' ' HIS . 1.0 OUTLIER -145.35 54.83 1.2 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.078 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -53.61 -39.88 65.28 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.15 -178.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.483 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 60.6 m-20 40.0 90.05 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 124.608 1.192 . . . . 0.0 112.596 170.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.546 HG11 ' HB2' ' A' ' 58' ' ' ALA . 11.7 p -92.32 136.94 23.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.407 -168.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -111.63 104.86 13.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 166.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.81 HG12 HD12 ' A' ' 54' ' ' LEU . 2.5 p -102.83 134.28 44.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 -171.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.511 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' HE2' ' HE2' ' A' ' 77' ' ' LYS . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.428 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.951 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.53 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.677 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.494 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.498 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.473 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.498 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.951 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.677 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.461 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.61 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.664 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.664 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.539 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.683 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.539 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.683 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.543 HG12 HG13 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.81 HD12 HG12 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -61.79 -41.24 97.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 56' ' ' ARG . 7.3 tpm_? -85.53 13.04 7.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.238 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.481 HD23 HG22 ' A' ' 12' ' ' VAL . 15.1 tp -106.68 -34.5 7.29 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.546 ' HB2' HG11 ' A' ' 12' ' ' VAL . . . -79.52 174.49 11.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.362 163.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.585 ' CD2' ' HA ' ' A' ' 9' ' ' SER . 15.8 p80 -75.32 18.33 0.22 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 177.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 58' ' ' ALA . . . 77.29 41.77 20.47 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 -165.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.493 ' O ' HG12 ' A' ' 63' ' ' VAL . . . -142.55 -125.63 2.02 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.483 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 8.9 tt0 -52.84 108.73 0.34 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.336 0.588 . . . . 0.0 110.896 177.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.543 HG13 HG12 ' A' ' 50' ' ' VAL . 2.4 p -138.29 103.89 2.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . 0.431 HD21 ' HA ' ' A' ' 64' ' ' ASN . 2.0 t-20 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.479 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' MET . . . . . 0.511 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.469 ' HG2' ' HG2' ' A' ' 90' ' ' GLN . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . 0.428 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.425 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.435 ' HA ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.53 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.743 ' CZ ' ' HD2' ' A' ' 78' ' ' PRO . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.679 HG11 ' HE2' ' A' ' 79' ' ' LYS . 9.8 m -150.16 102.62 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.841 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 11.0 ttmt -169.07 -76.48 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 167.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.841 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 15.6 Cg_exo -71.81 8.42 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.311 2.674 . . . . 0.0 113.348 -178.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.679 ' HE2' HG11 ' A' ' 76' ' ' VAL . 35.1 pttt -89.68 31.41 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.94 0.4 . . . . 0.0 111.699 -174.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.99 -55.52 4.54 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 114.294 0.478 . . . . 0.0 114.294 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.24 -63.69 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -174.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -157.43 143.26 17.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -82.72 1.51 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.113 -178.176 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 55.2 36.18 26.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.837 169.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -87.64 115.58 25.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.797 0.332 . . . . 0.0 110.368 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.0 t -141.36 146.36 36.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -107.74 -35.75 2.54 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.639 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -64.8 122.28 16.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -177.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.48 ' H ' ' HB3' ' A' ' 92' ' ' LEU . . . 93.71 -24.7 24.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.892 -0.67 . . . . 0.0 111.989 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.469 ' HG2' ' HG2' ' A' ' 68' ' ' GLU . 6.2 tp-100 -99.24 -61.96 1.3 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.003 0.43 . . . . 0.0 110.215 -178.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -114.72 47.32 1.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 109.584 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.623 ' H ' HD23 ' A' ' 92' ' ' LEU . 2.3 pt? -82.04 54.72 2.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.206 -174.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 93.38 29.78 9.84 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.427 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 m -78.77 2.49 19.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.032 0.444 . . . . 0.0 111.12 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -145.19 32.53 1.1 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.685 0.755 . . . . 0.0 109.924 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.416 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . -145.58 121.39 5.81 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.733 -177.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 21.1 Cg_exo -66.54 -25.58 47.64 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.918 2.412 . . . . 0.0 111.59 176.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -90.17 110.64 21.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.081 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.87 74.99 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.603 0.716 . . . . 0.0 110.715 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 tp -133.82 50.61 2.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.821 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 m 75.33 -57.25 0.6 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.177 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.252 1.202 0 CA-C-O 118.53 -0.748 . . . . 0.0 109.673 174.256 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 m -87.33 98.38 11.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.822 0.344 . . . . 0.0 111.119 -176.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -83.37 -64.83 1.09 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.409 0.623 . . . . 0.0 109.322 173.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.627 ' HZ1' ' HB3' ' A' ' 4' ' ' LYS . 4.6 mmmp? -129.18 -75.64 0.55 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.255 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? 57.69 -172.97 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.361 0.413 . . . . 0.0 110.796 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 57.83 71.68 0.56 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.516 171.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -113.6 90.8 3.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.89 0.852 . . . . 0.0 110.466 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.3 m -130.74 175.42 9.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.709 178.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 m 60.17 32.41 20.88 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 121.461 0.648 . . . . 0.0 110.475 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -84.83 -39.2 18.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.985 -177.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.472 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.6 m-20 65.67 125.49 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.892 0.745 . . . . 0.0 111.613 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.462 ' CG1' HG13 ' A' ' 63' ' ' VAL . 7.4 p -91.92 131.61 38.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 112.164 -169.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -103.98 110.85 23.15 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.477 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t -102.96 103.71 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.207 -170.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.885 HG13 ' HG2' ' A' ' 78' ' ' PRO . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.797 HD23 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.608 ' HD2' ' HA ' ' A' ' 77' ' ' LYS . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.869 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.432 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.797 ' HB2' HD23 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.532 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.415 ' N ' HD13 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.869 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.459 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.727 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.534 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.498 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.578 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.448 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.636 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.569 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.448 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -73.33 -27.29 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.636 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 38.0 mmt180 -78.53 -0.25 28.87 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.089 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -113.02 -59.53 2.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.425 ' HB3' ' HB ' ' A' ' 12' ' ' VAL . . . -98.6 136.36 38.8 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.404 0.621 . . . . 0.0 111.49 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -115.73 85.4 2.28 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.82 176.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -168.64 -40.99 0.03 OUTLIER Glycine 0 CA--C 1.504 -0.655 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 117.31 -15.52 13.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.797 -0.716 . . . . 0.0 113.431 173.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.472 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 7.0 tt0 -80.33 119.21 22.75 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 120.734 0.302 . . . . 0.0 110.345 178.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.462 HG13 ' CG1' ' A' ' 12' ' ' VAL . 12.8 m -127.75 103.33 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 177.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.546 HD11 HD11 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.62 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.432 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.62 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.427 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.684 ' CE1' ' HB3' ' A' ' 77' ' ' LYS . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.9 p -153.34 -41.48 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.684 ' HB3' ' CE1' ' A' ' 75' ' ' PHE . 16.5 ptmt 54.85 174.82 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 124.918 1.287 . . . . 0.0 112.126 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.885 ' HG2' HG13 ' A' ' 15' ' ' VAL . 23.2 Cg_exo -68.1 -49.47 0.99 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.908 1.738 . . . . 0.0 111.738 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.475 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 59.0 mttm 70.02 -54.32 0.62 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.418 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 158.71 -10.81 0.2 Allowed Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.11 -70.59 0.55 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -146.3 153.94 41.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.915 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.607 ' HE2' ' HZ ' ' A' ' 85' ' ' PHE . 22.0 pttm -92.52 93.9 8.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.074 0.464 . . . . 0.0 110.583 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.74 127.18 22.36 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.916 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.607 ' HZ ' ' HE2' ' A' ' 83' ' ' LYS . 93.3 m-85 -102.31 163.59 12.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.919 -178.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 99.0 m -131.3 117.47 19.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.963 171.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.07 -42.95 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.721 ' HA ' ' HA ' ' A' ' 92' ' ' LEU . 42.3 mt-10 -70.96 -36.68 72.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.998 0.427 . . . . 0.0 110.232 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.69 -11.34 84.57 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.29 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -92.73 -64.59 1.08 Allowed 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.88 -0.188 . . . . 0.0 110.942 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.42 -24.32 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.557 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.721 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 5.9 tt 70.65 -61.13 0.48 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.896 0.747 . . . . 0.0 110.939 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.66 130.52 1.56 Allowed Glycine 0 N--CA 1.444 -0.779 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 p -85.48 27.72 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.135 0.493 . . . . 0.0 111.426 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.3 m -68.94 -23.04 64.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.591 0.71 . . . . 0.0 109.532 174.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -128.38 86.83 56.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.152 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.76 -39.54 81.03 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.978 2.452 . . . . 0.0 112.797 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -118.22 132.26 56.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.535 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.99 63.68 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 109.896 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.2 tt -167.48 -57.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.066 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.3 m -69.67 145.75 52.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.911 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.368 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.0 -0.44 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.1 p -86.16 -34.06 20.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.172 0.51 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -75.05 -46.01 37.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.723 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -121.89 98.02 5.76 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.493 174.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.0 ptt180 -111.81 164.74 12.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.169 -172.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -148.83 -35.04 0.2 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.893 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -131.09 75.2 1.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 0.0 110.287 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.5 m -145.71 157.38 43.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.234 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t 56.98 43.9 23.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.711 0.767 . . . . 0.0 109.082 -172.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 15.3 mm100 -91.73 46.52 1.29 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.6 -175.273 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.541 ' OD1' ' HG2' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -23.34 130.58 0.02 OUTLIER 'General case' 0 C--O 1.237 0.439 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.81 173.348 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.57 HG12 ' HB1' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -85.5 117.24 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.733 0.777 . . . . 0.0 109.225 168.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -100.4 104.24 15.66 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.465 HG21 HD12 ' A' ' 54' ' ' LEU . 3.4 t -99.46 102.1 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.239 -164.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.546 HG12 ' HD3' ' A' ' 77' ' ' LYS . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.811 HD23 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.544 ' HZ2' ' CD ' ' A' ' 68' ' ' GLU . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.423 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.901 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.495 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.495 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.811 ' HB2' HD23 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.583 ' CD1' ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.429 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.901 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ARG . . . . . 0.63 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.423 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.577 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.449 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.627 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.477 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.627 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.52 HG12 HG22 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.449 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.631 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.465 HD12 HG21 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.43 ' C ' ' H ' ' A' ' 57' ' ' LEU . 7.2 tpt180 -61.43 -57.41 12.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -81.4 47.44 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.765 0.793 . . . . 0.0 109.684 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.43 ' H ' ' C ' ' A' ' 55' ' ' ARG . 39.1 tp -129.63 -51.75 1.16 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.186 168.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.57 ' HB1' HG12 ' A' ' 12' ' ' VAL . . . -57.98 137.82 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.18 172.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.447 ' HB2' ' HB2' ' A' ' 10' ' ' GLN . 23.9 m-70 -98.16 78.44 2.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.657 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 165.72 -33.61 0.24 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.108 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.95 -15.09 55.72 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.854 -0.689 . . . . 0.0 113.4 174.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . 0.541 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 5.6 tt0 -71.88 125.94 28.46 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.52 HG22 HG12 ' A' ' 50' ' ' VAL . 41.6 t -131.26 106.83 12.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -176.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.589 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.544 ' CD ' ' HZ2' ' A' ' 17' ' ' LYS . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.611 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.7 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.611 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PHE . . . . . 0.579 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p -171.59 110.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.726 ' HB3' ' CD ' ' A' ' 78' ' ' PRO . 22.2 ttmt -161.46 -86.21 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 118.655 -0.688 . . . . 0.0 112.615 175.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.726 ' CD ' ' HB3' ' A' ' 77' ' ' LYS . 38.3 Cg_endo -64.36 -16.51 55.5 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 122.472 2.115 . . . . 0.0 111.82 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -66.83 -44.36 81.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.088 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.47 70.14 0.87 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.746 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.46 -79.52 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.47 0.708 . . . . 0.0 112.235 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . 0.47 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 72.6 m-85 -136.66 -84.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -174.422 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -94.56 -9.39 35.36 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.109 -0.237 . . . . 0.0 111.476 -174.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.12 -168.72 0.17 Allowed 'General case' 0 C--O 1.237 0.421 0 O-C-N 123.82 0.7 . . . . 0.0 111.362 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -166.44 140.05 4.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.981 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -76.96 -24.82 52.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.071 0.462 . . . . 0.0 110.603 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.24 -69.73 3.08 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.658 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.85 -37.83 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.401 0.62 . . . . 0.0 110.794 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 114.45 143.44 8.27 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.642 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -104.21 -15.32 15.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.367 0.603 . . . . 0.0 109.797 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -85.06 -50.86 7.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.397 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.8 tp 48.14 52.61 12.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.138 0.971 . . . . 0.0 110.461 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' A' ' 94' ' ' SER . . . 169.82 89.44 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 93' ' ' GLY . 69.1 m 73.86 125.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -163.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 10.5 m -50.98 -42.35 60.14 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -166.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . 73.12 126.19 0.03 OUTLIER Pre-proline 0 C--O 1.235 0.293 0 O-C-N 123.919 0.762 . . . . 0.0 110.498 -174.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 16.8 Cg_exo -65.68 159.77 46.7 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.704 2.269 . . . . 0.0 111.841 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -72.72 -97.51 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.745 -178.523 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.439 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 18.7 t 43.89 -96.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.162 0.585 . . . . 0.0 111.338 -177.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 99' ' ' VAL . 13.5 tp 175.47 -60.5 0.01 OUTLIER 'General case' 0 C--O 1.231 0.109 0 C-N-CA 123.125 0.57 . . . . 0.0 110.196 176.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.2 m -87.66 39.08 0.86 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.225 -172.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.818 -177.09 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.9 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.714 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.492 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.658 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.9 ' HB2' HD21 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.443 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.784 HD13 HD21 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.74 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.829 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.655 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.662 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.719 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.4 HG21 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.524 HG21 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.555 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.784 HD21 HD13 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.524 HH11 HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.42 HG21 ' HD2' ' A' ' 55' ' ' ARG . 46.0 t . . . . . 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.587 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.829 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.538 HG21 HD22 ' A' ' 54' ' ' LEU . 15.3 m . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.958 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.467 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.787 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.958 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.538 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.537 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.787 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.611 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.575 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.664 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.664 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.446 HE22 ' HG2' ' A' ' 53' ' ' GLU . 0.5 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.578 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.49 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.538 HD22 HG21 ' A' ' 14' ' ' VAL . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.445 -0.687 0 CA-C-O 121.307 0.575 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.709 HD11 HD12 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.483 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.741 ' HB2' HD12 ' A' ' 30' ' ' LEU . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.514 HG12 ' HH2' ' A' ' 19' ' ' TRP . 8.9 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 N--CA 1.449 -0.513 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.713 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.794 HD12 HD21 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB3' ' CZ2' ' A' ' 19' ' ' TRP . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.939 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.663 ' CZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 1.036 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.63 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.663 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.672 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.43 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.543 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.652 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.589 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.543 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 . . . . . 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 50' ' ' VAL . 5.5 m . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.794 HD21 HD12 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.438 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.616 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.638 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.682 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 1.036 ' HB2' HD12 ' A' ' 30' ' ' LEU . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.443 -0.802 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.864 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.795 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.472 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.622 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.558 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.558 HD21 HD22 ' A' ' 25' ' ' LEU . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.526 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.494 ' CE1' ' HD1' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.68 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.677 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.611 ' HD2' HD11 ' A' ' 54' ' ' LEU . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.508 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.594 ' HD3' ' C ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.806 HD11 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.634 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.929 HG21 HD22 ' A' ' 54' ' ' LEU . 77.4 t . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.843 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.843 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 71' ' ' ARG . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.514 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.751 ' HB2' HD21 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.649 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.625 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.781 ' HB2' HG13 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.442 ' OD1' HD21 ' A' ' 54' ' ' LEU . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.921 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.522 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.742 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.742 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.724 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.61 HD13 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.492 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 50' ' ' VAL . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.724 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.929 HD22 HG21 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' A' ' 54' ' ' LEU . 2.6 p . . . . . 0 N--CA 1.446 -0.66 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.501 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.895 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 76' ' ' VAL . 7.5 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 54' ' ' LEU . 40.6 t . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.443 HD21 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.78 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.491 ' HG3' ' H ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.548 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.56 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.78 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.507 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.806 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.806 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.761 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD11 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.727 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.727 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.463 HG11 HG13 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.412 ' HD2' HD12 ' A' ' 54' ' ' LEU . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.761 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.463 HG13 HG11 ' A' ' 50' ' ' VAL . 2.6 p . . . . . 0 N--CA 1.437 -1.117 0 CA-C-O 121.712 0.768 . . . . 0.0 108.974 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 67.0 t30 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.519 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.519 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.583 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 74' ' ' ASP . 4.9 t . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.563 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.689 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.918 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.404 ' N ' HD23 ' A' ' 16' ' ' LEU . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.831 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.918 ' HB2' HD21 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.521 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.831 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.647 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.667 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.667 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.659 HD21 HD12 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.559 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.461 HG11 ' HA ' ' A' ' 55' ' ' ARG . 5.2 m . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.855 HD11 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.473 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.41 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.639 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.737 ' HB2' HD12 ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.404 ' HA ' ' HB2' ' A' ' 26' ' ' ASP . 32.0 t . . . . . 0 N--CA 1.444 -0.733 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.882 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.587 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.882 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.556 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.64 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.403 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.777 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.587 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.683 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.777 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.817 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HD11 ' A' ' 54' ' ' LEU . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.817 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.442 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.892 ' HB2' HD12 ' A' ' 30' ' ' LEU . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 76' ' ' VAL . 7.2 p . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 54' ' ' LEU . 36.0 t . . . . . 0 CA--C 1.507 -0.71 0 CA-C-O 121.098 0.475 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HE2' ' OE1' ' A' ' 68' ' ' GLU . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.742 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.43 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.727 ' HB2' HD21 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.742 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 25' ' ' LEU . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.572 HD13 ' HD1' ' A' ' 19' ' ' TRP . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.445 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.79 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.79 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.598 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.579 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.579 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.716 HG13 HD12 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.716 HD12 HG13 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.451 -0.378 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.489 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.675 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.52 ' HB2' HD22 ' A' ' 30' ' ' LEU . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' HG13 ' A' ' 76' ' ' VAL . 5.6 p . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 26' ' ' ASP . 1.9 m . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.728 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.876 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.618 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.595 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.553 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' OD1' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.572 ' HB3' HG12 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.497 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 3.0 p-10 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.595 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.54 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.595 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.853 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.716 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.608 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.853 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.608 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.488 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.526 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.696 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 76' ' ' VAL . 7.0 p . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.802 HG11 HD22 ' A' ' 54' ' ' LEU . 13.1 m . . . . . 0 N--CA 1.441 -0.894 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.776 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.847 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.504 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.776 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.45 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.717 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.472 ' OD1' HD12 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.866 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.486 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.646 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.737 HG23 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.646 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.802 HD22 HG11 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 55' ' ' ARG . 1.4 tpp180 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.737 HG11 HG23 ' A' ' 50' ' ' VAL . 54.5 t . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.785 0.326 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.437 HD11 HD12 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.679 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.866 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.814 HG11 HD22 ' A' ' 54' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.45 -0.445 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.861 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.861 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.488 HD21 ' HD2' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.736 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.68 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.577 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.544 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.736 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.68 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.671 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.671 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.652 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.541 HG11 HG13 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.652 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.814 HD22 HG11 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.541 HG13 HG11 ' A' ' 50' ' ' VAL . 7.4 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.494 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HD2' HD21 ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.665 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.632 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.522 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.867 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.495 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.661 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.542 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.454 ' HB3' HG12 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.416 ' HD3' ' HB3' ' A' ' 38' ' ' ASN . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.661 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.834 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.834 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.748 HG11 HH21 ' A' ' 55' ' ' ARG . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.54 ' HD2' HD11 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.689 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.54 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.748 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.746 HG11 HG21 ' A' ' 50' ' ' VAL . 3.6 p . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.457 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.535 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.933 HG13 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.629 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.933 ' HE3' HG13 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.959 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.629 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.6 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.512 ' N ' HD22 ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 15' ' ' VAL . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.959 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.663 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.605 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.787 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.787 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.524 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.695 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.532 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.627 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 121.509 0.671 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.559 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.596 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.859 ' HB2' HD12 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.118 0.485 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.56 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.837 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.535 ' HB2' HD21 ' A' ' 16' ' ' LEU . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.502 ' N ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.528 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.404 ' HD1' HD11 ' A' ' 42' ' ' LEU . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.68 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD11 ' HD1' ' A' ' 33' ' ' TYR . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 43' ' ' GLU . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.486 ' HD2' HD11 ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.486 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB2' HD12 ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.73 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.61 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.873 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.535 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.726 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.669 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.726 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.545 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.741 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.741 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.535 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.637 ' HD2' HD12 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.73 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.728 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.61 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.572 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.579 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.572 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.53 HG21 HD22 ' A' ' 54' ' ' LEU . 33.1 t . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.52 ' HG2' ' HB2' ' A' ' 68' ' ' GLU . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.954 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.59 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.99 ' HB2' HD21 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.714 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.666 ' H ' HD12 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.954 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.633 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.524 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.679 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.679 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.539 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 42' ' ' LEU . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.457 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.627 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.539 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.601 ' HG3' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.756 ' HB2' HD12 ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.522 HG13 ' O ' ' A' ' 76' ' ' VAL . 9.2 p . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.818 HG11 HD13 ' A' ' 54' ' ' LEU . 2.5 p . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.528 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.953 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.688 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.475 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.953 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.688 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.602 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.667 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.667 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.818 HD13 HG11 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 50' ' ' VAL . 2.4 p . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 121.098 0.475 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' MET . . . . . 0.528 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.512 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.55 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.783 ' HB2' HD12 ' A' ' 30' ' ' LEU . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 76' ' ' VAL . 9.8 m . . . . . 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.491 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.356 0.598 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.796 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.888 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.486 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.796 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.569 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.408 HD21 HD22 ' A' ' 25' ' ' LEU . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.888 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.486 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.743 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.558 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.51 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.45 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.618 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.62 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.506 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.803 ' HB2' HD12 ' A' ' 30' ' ' LEU . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 54' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.432 -1.369 0 CA-C-O 121.696 0.76 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.465 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.934 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.642 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.804 ' HB2' HD21 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.435 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.465 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.567 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.461 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.537 HG11 HG21 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.537 HG21 HG11 ' A' ' 50' ' ' VAL . 41.6 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 55.7 t30 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.637 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.708 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PHE . . . . . 0.608 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -78.87 -40.13 33.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 67.95 -75.38 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.652 0.595 . . . . 0.0 111.427 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -154.4 79.12 1.1 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 0.0 110.328 -178.927 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.79 -74.62 0.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -173.57 158.98 3.51 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.841 176.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -87.84 94.03 9.64 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 m -39.06 109.14 0.1 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 124.489 1.118 . . . . 0.0 112.877 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.7 t -80.84 72.4 7.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.442 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -117.88 23.45 11.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.052 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 56.39 88.42 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.871 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.474 ' CG2' ' HB2' ' A' ' 58' ' ' ALA . 14.5 m -119.2 167.18 12.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.527 0.68 . . . . 0.0 112.118 -167.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 61.2 m-70 -104.18 132.54 50.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.117 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m -103.42 111.97 35.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 171.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.9 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD2' ' HB2' ' A' ' 77' ' ' LYS . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.714 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.492 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.658 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.9 ' HB2' HD21 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.443 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.784 HD13 HD21 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.74 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.829 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.655 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.662 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.719 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.4 HG21 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.524 HG21 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.555 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.784 HD21 HD13 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.524 HH11 HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -74.51 -21.12 59.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 37.6 mmt180 -87.32 9.68 19.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.86 170.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -113.17 -58.83 2.1 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.965 ' HB3' HG22 ' A' ' 63' ' ' VAL . . . -90.41 160.03 16.27 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.232 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.406 ' C ' ' H ' ' A' ' 61' ' ' GLY . 0.2 OUTLIER -59.78 160.68 7.2 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 169.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.34 33.13 0.55 Allowed Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.906 -0.664 . . . . 0.0 114.399 -170.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' A' ' 59' ' ' HIS . . . -102.08 -131.09 7.23 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 176.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -66.59 87.0 0.12 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.393 0.616 . . . . 0.0 111.29 175.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.965 HG22 ' HB3' ' A' ' 58' ' ' ALA . 46.0 t -97.1 101.45 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 165.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.587 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.829 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.33 97.94 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.674 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -138.77 -65.06 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.804 0 O-C-N 122.215 -0.303 . . . . 0.0 111.393 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.674 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 23.5 Cg_exo -71.62 -32.22 12.27 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 123.862 3.041 . . . . 0.0 111.851 174.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -36.41 -48.84 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 113.687 -1.597 . . . . 0.0 113.605 -177.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 163.0 172.92 31.09 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.332 -0.937 . . . . 0.0 111.8 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 62.04 -169.64 0.17 Allowed 'General case' 0 C--O 1.232 0.144 0 O-C-N 124.062 0.507 . . . . 0.0 110.62 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.429 ' C ' ' H ' ' A' ' 84' ' ' ALA . 85.9 m-85 -128.15 136.68 51.46 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' C ' ' HZ1' ' A' ' 17' ' ' LYS . 16.6 mtmt 64.9 -7.59 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.74 0.816 . . . . 0.0 112.748 -175.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.429 ' H ' ' C ' ' A' ' 82' ' ' PHE . . . 61.42 35.17 17.87 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.076 0.55 . . . . 0.0 110.984 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.575 ' HB2' ' HA ' ' A' ' 91' ' ' LYS . 96.3 m-85 66.04 72.41 0.4 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.459 175.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -97.92 12.79 32.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.495 173.253 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -90.18 103.32 3.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.803 -175.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 52.35 79.15 0.11 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.516 0.674 . . . . 0.0 110.845 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.72 -157.23 15.34 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -175.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.47 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 2.8 tp-100 -150.08 109.87 4.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 117.152 0.476 . . . . 0.0 110.713 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 85' ' ' PHE . 5.7 ttpm? 72.96 -40.07 0.46 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.825 0.85 . . . . 0.0 111.656 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.2 mt 54.19 59.65 4.08 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.783 0.433 . . . . 0.0 111.824 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.62 -30.81 4.42 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.044 -0.598 . . . . 0.0 113.657 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.531 ' HB3' ' CG ' ' A' ' 91' ' ' LYS . 38.0 p 46.61 51.07 12.43 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.215 0.531 . . . . 0.0 111.383 -176.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 p -80.83 57.84 3.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 111.377 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.75 90.79 32.91 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.975 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.45 -9.21 25.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.57 2.18 . . . . 0.0 112.381 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.92 166.5 17.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.766 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.8 t -95.54 -36.55 6.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.081 0.467 . . . . 0.0 110.806 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 52.0 mt -105.34 160.85 14.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.736 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.9 m 69.31 14.9 8.54 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.501 0.501 . . . . 0.0 111.817 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.3 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.819 176.499 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.944 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -79.97 87.58 5.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' A' ' 5' ' ' ARG . 10.3 pt-20 -137.48 176.81 8.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.189 0.518 . . . . 0.0 111.459 -169.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' N ' ' HD2' ' A' ' 4' ' ' LYS . 11.0 mptt -95.33 -7.82 37.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.328 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.445 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 7.3 tpt180 68.72 -86.88 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.914 177.32 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.445 ' H ' ' HB3' ' A' ' 5' ' ' ARG . 94.3 mt-30 52.95 -103.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.955 0.502 . . . . 0.0 111.722 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.0 m170 66.38 -77.27 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.984 0.513 . . . . 0.0 111.211 -175.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.505 ' HB3' ' O ' ' A' ' 11' ' ' ASP . 27.8 m -97.43 113.13 24.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.969 0.414 . . . . 0.0 110.14 -178.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 p -101.58 -49.02 4.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 110.74 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 61.6 mt-30 -83.74 -48.31 10.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.468 -178.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.537 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 6.6 p-10 -145.6 144.55 30.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.701 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.82 ' HB ' ' HB2' ' A' ' 58' ' ' ALA . 2.5 p -111.98 119.04 59.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.109 168.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -112.02 104.34 12.59 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.538 HG21 HD22 ' A' ' 54' ' ' LEU . 15.3 m -104.55 127.87 58.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 -178.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.958 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' CE ' ' HA ' ' A' ' 78' ' ' PRO . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.467 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.787 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.958 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.538 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.537 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.787 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.611 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.575 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.664 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.664 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.446 HE22 ' HG2' ' A' ' 53' ' ' GLU . 0.5 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.578 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.49 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.538 HD22 HG21 ' A' ' 14' ' ' VAL . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.414 ' NH2' ' H ' ' A' ' 61' ' ' GLY . 0.0 OUTLIER -66.14 -44.23 84.79 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 25.3 mmt180 -83.03 44.9 0.97 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.285 0.564 . . . . 0.0 109.933 178.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -137.03 -58.14 0.71 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.82 ' HB2' ' HB ' ' A' ' 12' ' ' VAL . . . -75.7 141.33 42.71 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.942 170.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -45.66 -49.46 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.691 0.619 . . . . 0.0 112.283 -173.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 160.46 71.67 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 119.84 -1.172 . . . . 0.0 113.628 173.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.414 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . -156.43 -127.73 1.03 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.858 168.066 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 31.7 tt0 -52.04 116.42 2.18 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.33 0.586 . . . . 0.0 111.155 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.584 HG23 HG13 ' A' ' 12' ' ' VAL . 3.6 p -133.92 104.51 6.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.17 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.709 HD11 HD12 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.609 ' HE1' HG23 ' A' ' 86' ' ' THR . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.483 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.776 ' CZ ' ' HD3' ' A' ' 78' ' ' PRO . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.514 HG12 ' HH2' ' A' ' 19' ' ' TRP . 8.9 p -106.08 6.45 10.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.742 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 4.2 mtpt 80.9 144.84 0.09 OUTLIER Pre-proline 0 N--CA 1.47 0.54 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.053 177.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.776 ' HD3' ' CZ ' ' A' ' 75' ' ' PHE . 17.2 Cg_exo -68.86 -76.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.641 2.227 . . . . 0.0 110.643 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.814 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 9.6 mmpt? 66.02 -76.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 O-C-N 123.858 0.724 . . . . 0.0 111.417 170.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.94 94.65 2.36 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.36 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.587 ' H ' ' HB2' ' A' ' 85' ' ' PHE . . . 72.71 -34.75 0.31 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.726 0.81 . . . . 0.0 112.557 176.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -52.26 -39.9 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.14 0.495 . . . . 0.0 110.397 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.45 130.87 7.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.607 174.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 59.84 51.85 5.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.522 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.587 ' HB2' ' H ' ' A' ' 81' ' ' ALA . 42.3 t80 -90.33 59.24 4.31 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 172.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.609 HG23 ' HE1' ' A' ' 70' ' ' HIS . 2.8 t -114.45 74.49 0.88 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.029 -172.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.88 -46.31 5.71 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.219 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -87.63 89.06 7.85 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 139.24 72.32 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -176.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -100.6 167.95 10.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 110.896 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -73.44 104.71 4.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.063 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.5 63.7 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -142.04 164.49 26.82 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.79 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.5 m 59.21 51.52 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.334 0.588 . . . . 0.0 109.933 -176.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.7 p -76.51 77.18 3.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.454 -175.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -127.54 99.5 26.86 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.94 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.64 -51.58 9.51 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.049 2.499 . . . . 0.0 111.656 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 59.4 178.87 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.85 0.833 . . . . 0.0 113.085 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.9 p -89.57 -28.02 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.962 176.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.7 mt -147.6 135.82 21.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.062 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.2 m 62.38 -161.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.728 0.642 . . . . 0.0 111.814 173.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.454 -177.614 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t 65.13 -173.83 0.18 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.008 0.523 . . . . 0.0 110.825 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -138.06 148.39 45.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.443 -177.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 32.9 ttpt 59.31 53.12 5.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.436 0.636 . . . . 0.0 110.664 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 10.0 mmm180 -130.35 177.87 7.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.855 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' ' CZ ' ' A' ' 5' ' ' ARG . 15.0 mm100 65.6 174.38 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.872 0.732 . . . . 0.0 110.931 -177.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.442 ' HB2' ' OE1' ' A' ' 10' ' ' GLN . 28.1 m80 -63.68 -62.19 1.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.076 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t 69.93 -50.76 0.64 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.593 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 59' ' ' HIS . 19.8 m -74.01 44.6 0.19 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 111.437 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.442 ' OE1' ' HB2' ' A' ' 7' ' ' HIS . 28.1 mt-30 -95.41 -12.95 25.1 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.588 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 73.4 m-20 62.25 165.58 0.1 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.933 -175.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.738 HG13 ' HB2' ' A' ' 58' ' ' ALA . 2.1 m -125.21 126.6 71.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.269 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 32.7 t60 -103.86 103.14 12.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 167.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -102.78 117.2 47.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.713 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.794 HD12 HD21 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB3' ' CZ2' ' A' ' 19' ' ' TRP . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.939 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.663 ' CZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 1.036 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.63 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 18.0 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.663 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.672 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.43 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.543 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.652 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.589 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.543 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 -64.73 -45.62 85.72 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.461 ' HA ' ' HD3' ' A' ' 56' ' ' ARG . 17.0 mmt180 -88.13 36.42 0.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.456 174.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER -120.7 -56.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 168.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.738 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -77.36 178.98 6.72 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.29 165.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.628 ' HB2' ' HA ' ' A' ' 9' ' ' SER . 10.5 t60 -56.67 -26.65 57.0 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.711 169.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 110.72 6.35 26.79 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.289 -176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.61 -94.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.666 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.588 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 40.0 tt0 -84.24 83.47 7.96 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.755 0.788 . . . . 0.0 109.172 178.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 50' ' ' VAL . 5.5 m -93.35 102.24 13.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.318 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.794 HD21 HD12 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.438 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.616 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.638 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.682 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 1.036 ' HB2' HD12 ' A' ' 30' ' ' LEU . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p -90.31 -9.27 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.766 ' HE3' ' CZ ' ' A' ' 75' ' ' PHE . 19.7 mtpt 77.51 143.74 0.1 OUTLIER Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 114.545 -1.207 . . . . 0.0 113.452 168.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.485 ' HB3' HG11 ' A' ' 15' ' ' VAL . 10.9 Cg_exo -77.85 -61.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.085 2.524 . . . . 0.0 109.603 163.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.412 ' HG2' ' H ' ' A' ' 79' ' ' LYS . 0.9 OUTLIER -70.25 97.29 1.21 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.407 -1.27 . . . . 0.0 109.86 171.08 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 130.84 -0.62 5.41 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 -175.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.15 -172.57 2.16 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -110.67 -54.26 2.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.63 0.252 . . . . 0.0 110.905 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -88.2 -27.03 22.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.295 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 66.66 -67.16 0.16 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 124.079 0.862 . . . . 0.0 112.305 176.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -106.51 127.58 53.42 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 2.8 m -72.43 -35.42 68.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.596 -174.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 122.83 121.41 2.68 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 41.98 35.42 0.55 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.101 0.96 . . . . 0.0 111.835 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.58 -95.12 0.12 Allowed Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.4 -174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -176.39 43.22 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm 63.88 -141.64 0.31 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.596 -173.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 81.2 mt 71.97 -71.6 0.13 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.958 0.503 . . . . 0.0 111.4 177.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.97 8.16 57.56 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.382 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -70.39 -25.76 63.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.97 0.414 . . . . 0.0 111.227 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.9 m -154.35 136.21 14.54 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.863 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 66.25 84.15 0.18 Allowed Pre-proline 0 CA--C 1.533 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 111.414 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 33.2 Cg_endo -64.9 118.86 5.8 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.838 2.359 . . . . 0.0 112.537 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.684 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 19.8 pt20 46.27 -81.68 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.974 1.31 . . . . 0.0 113.945 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.684 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 9.6 p -122.5 0.71 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.307 0.575 . . . . 0.0 111.014 -175.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.561 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 54.4 mt -95.43 117.55 30.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.925 -177.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -90.06 -14.88 32.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.796 0.332 . . . . 0.0 110.288 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.245 -179.862 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 112.229 -0.349 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m -137.64 142.4 41.18 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 177.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.54 -50.26 1.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.147 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 59' ' ' HIS . 86.8 mttt 54.69 41.82 31.66 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.753 0.787 . . . . 0.0 109.138 -175.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -107.9 -58.71 1.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.472 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -132.68 -32.45 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.55 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -92.79 41.39 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.503 0.668 . . . . 0.0 109.355 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 m -75.01 102.87 4.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.346 -0.843 . . . . 0.0 108.822 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.632 ' HB3' HG13 ' A' ' 12' ' ' VAL . 2.0 m -59.46 -51.73 68.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.665 -171.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.935 ' H ' ' HA3' ' A' ' 60' ' ' GLY . 22.3 mm-40 70.15 -24.26 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.085 0.954 . . . . 0.0 110.826 -177.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.609 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 1.0 OUTLIER -174.13 130.76 0.39 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.451 177.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.632 HG13 ' HB3' ' A' ' 9' ' ' SER . 35.2 m -137.95 144.38 31.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.4 0.619 . . . . 0.0 110.187 172.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -102.64 129.82 49.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.913 169.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.27 104.79 16.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.732 HG11 ' HG2' ' A' ' 78' ' ' PRO . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.864 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.795 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.472 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.622 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.558 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.558 HD21 HD22 ' A' ' 25' ' ' LEU . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.526 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.494 ' CE1' ' HD1' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.68 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.677 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.611 ' HD2' HD11 ' A' ' 54' ' ' LEU . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.508 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.594 ' HD3' ' C ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -63.65 -43.69 96.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.0 mmt85 -86.25 22.23 1.85 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.647 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.6 tt -111.09 -50.33 2.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 171.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.462 ' HB2' ' CG2' ' A' ' 12' ' ' VAL . . . -59.6 124.72 21.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.313 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' O ' ' HE2' ' A' ' 4' ' ' LYS . 30.4 m170 -99.27 -12.79 20.05 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.556 -175.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.935 ' HA3' ' H ' ' A' ' 10' ' ' GLN . . . -93.23 -51.8 2.16 Favored Glycine 0 CA--C 1.503 -0.662 0 C-N-CA 120.455 -0.878 . . . . 0.0 111.843 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 158.58 -63.57 0.3 Allowed Glycine 0 CA--C 1.494 -1.23 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.661 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.609 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 42.8 tt0 -62.25 108.64 1.12 Allowed 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.183 0.516 . . . . 0.0 111.216 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.32 102.98 11.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.119 175.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.806 HD11 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.634 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.43 HG13 ' N ' ' A' ' 77' ' ' LYS . 14.2 p -148.07 -46.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.817 ' HB3' ' HG3' ' A' ' 79' ' ' LYS . 6.2 mtpt 64.0 164.86 0.12 Allowed Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 176.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.732 ' HG2' HG11 ' A' ' 15' ' ' VAL . 16.9 Cg_exo -71.83 -65.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.475 2.783 . . . . 0.0 110.156 170.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.817 ' HG3' ' HB3' ' A' ' 77' ' ' LYS . 53.2 mtpt 50.39 -103.91 0.14 Allowed 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.713 0.633 . . . . 0.0 112.431 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.94 6.21 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.497 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -105.21 -41.02 5.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.66 -0.27 . . . . 0.0 110.498 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 52.18 53.38 12.54 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 123.549 0.531 . . . . 0.0 110.051 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.496 ' HB2' ' HE3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.2 -39.22 89.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.671 -172.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 83' ' ' LYS . . . -169.41 159.25 8.51 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.956 0.408 . . . . 0.0 111.285 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -138.6 47.2 1.97 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.566 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.7 p -97.39 127.88 43.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.33 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' A' ' 88' ' ' GLU . . . -129.02 148.09 17.98 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 174.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 87' ' ' GLY . 14.4 tp10 77.2 -40.81 0.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.44 0.696 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -125.33 93.91 0.44 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.161 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -83.56 -29.32 27.93 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -110.84 83.73 1.81 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.583 173.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 pp -102.24 19.75 18.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.078 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.02 65.11 0.56 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.445 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.1 m -124.13 177.72 5.68 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.791 -0.078 . . . . 0.0 110.791 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.8 p 49.9 82.65 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.367 0.667 . . . . 0.0 111.902 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -165.42 97.73 0.81 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.59 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 22.6 Cg_exo -65.0 87.48 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.288 2.658 . . . . 0.0 112.81 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' A' ' 99' ' ' VAL . 27.6 mm-40 -134.95 -154.15 0.56 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.082 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.405 ' H ' ' HB3' ' A' ' 98' ' ' GLN . 48.5 t -67.7 -44.48 85.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.332 0.587 . . . . 0.0 109.557 175.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.3 mp -105.32 161.14 14.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.773 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t 73.82 -84.16 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.182 175.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 97' ' ' PRO . 79.5 m . . . . . 0 C--O 1.251 1.18 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -167.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 111.546 -0.621 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.2 m -137.35 123.85 20.86 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.714 0.293 . . . . 0.0 110.726 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -141.76 137.31 31.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -84.64 130.19 34.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.295 0.569 . . . . 0.0 110.276 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.764 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 0.4 OUTLIER -86.38 -151.93 0.17 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.234 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.764 ' H ' ' HG3' ' A' ' 5' ' ' ARG . 5.6 mm100 -63.87 -45.67 88.4 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -176.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -137.47 149.79 47.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.102 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.1 p -122.21 37.27 4.42 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.781 0.324 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 p -133.38 28.37 4.04 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -175.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 28.28 3.1 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.357 -0.214 . . . . 0.0 110.665 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.719 ' HA ' ' CA ' ' A' ' 62' ' ' GLN . 10.7 m-20 20.31 104.37 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.796 1.638 . . . . 0.0 113.956 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.526 HG22 ' O ' ' A' ' 62' ' ' GLN . 26.7 m -59.05 164.16 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 120.995 0.426 . . . . 0.0 110.78 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -124.72 107.8 11.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.192 0.52 . . . . 0.0 110.379 -174.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.929 HG21 HD22 ' A' ' 54' ' ' LEU . 77.4 t -104.06 114.55 43.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.342 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.843 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.843 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 71' ' ' ARG . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.514 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.751 ' HB2' HD21 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.649 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.625 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.781 ' HB2' HG13 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.442 ' OD1' HD21 ' A' ' 54' ' ' LEU . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.921 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.522 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.742 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.742 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.724 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.61 HD13 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.492 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.492 ' HD3' ' HA ' ' A' ' 50' ' ' VAL . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.724 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.929 HD22 HG21 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -40.52 97.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -84.22 43.26 0.93 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.478 0.656 . . . . 0.0 109.994 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 tp -153.75 -49.42 0.09 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.704 176.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.531 ' CB ' ' HB ' ' A' ' 63' ' ' VAL . . . -69.02 148.22 50.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.536 175.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 74.8 m80 -100.18 125.93 46.39 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -175.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.35 15.12 74.78 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.373 172.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.88 8.6 63.32 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.36 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.719 ' CA ' ' HA ' ' A' ' 11' ' ' ASP . 42.3 tt0 -65.81 62.38 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.907 0.883 . . . . 0.0 110.096 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' ' CB ' ' A' ' 58' ' ' ALA . 2.6 p -145.21 123.69 5.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 -174.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' A' ' 90' ' ' GLN . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.501 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.895 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 76' ' ' VAL . 7.5 p -175.18 53.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' A' ' 83' ' ' LYS . 2.0 tppt? -133.73 -56.54 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 O-C-N 121.044 -1.035 . . . . 0.0 113.379 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.649 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 39.3 Cg_exo -66.07 -41.27 13.63 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.721 2.281 . . . . 0.0 111.905 175.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -133.05 151.48 52.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.882 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 92.74 -37.51 3.38 Favored Glycine 0 CA--C 1.511 -0.214 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.76 174.46 10.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.71 114.99 28.34 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.9 0.381 . . . . 0.0 110.864 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.756 ' HB3' ' HG3' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.41 96.96 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.484 0.659 . . . . 0.0 110.965 178.871 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -92.12 6.62 45.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.045 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 60.1 t80 64.43 102.59 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.562 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.2 t -141.41 128.7 21.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.452 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.48 -42.9 4.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.141 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -92.45 137.71 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.36 -14.98 25.27 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.617 -178.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.424 ' HB3' ' O ' ' A' ' 69' ' ' ASP . 80.5 mt-30 -70.96 -74.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 109.96 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.898 ' HG2' ' HB2' ' A' ' 94' ' ' SER . 14.0 tppt? 178.02 -61.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.158 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 92' ' ' LEU . 0.3 OUTLIER 59.87 83.31 0.14 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.163 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.87 41.65 0.77 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.673 -177.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.898 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 15.8 t -103.05 121.55 42.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.7 m 60.37 89.07 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 111.517 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 101' ' ' SER . . . -56.8 116.52 13.42 Favored Pre-proline 0 C--O 1.236 0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.013 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.836 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 50.9 Cg_endo -70.96 81.06 1.16 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.045 2.497 . . . . 0.0 112.83 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.722 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 15.3 pt20 44.43 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.283 . . . . 0.0 113.711 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.722 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 12.3 p -72.52 -26.01 23.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.978 0.418 . . . . 0.0 110.969 -176.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 55.3 mt -105.84 177.01 4.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.839 -177.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.433 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . 32.4 t -138.36 27.82 2.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.142 0.496 . . . . 0.0 109.856 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.142 -178.115 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.694 0 N-CA-C 112.35 -0.3 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -97.85 54.7 1.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.307 . . . . 0.0 111.211 -177.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 4' ' ' LYS . 1.9 tm-20 -59.09 -69.94 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.065 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 3' ' ' GLU . 15.7 pttm -129.17 -155.04 0.67 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 77.48 -48.2 0.5 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.763 0.825 . . . . 0.0 109.813 -174.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 61.4 25.14 15.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.787 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -123.93 109.92 14.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.433 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m -85.65 -24.01 27.24 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 167.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.5 m -84.87 68.33 10.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.133 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.607 ' HG3' ' HB2' ' A' ' 59' ' ' HIS . 9.6 mm100 -95.81 40.99 1.11 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 173.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 8.1 p-10 -46.51 111.29 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.644 -174.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.589 HG22 ' HB2' ' A' ' 58' ' ' ALA . 19.2 m -144.75 165.46 12.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.344 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.517 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 16.6 m-70 -116.85 125.72 51.96 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.797 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 54' ' ' LEU . 40.6 t -102.8 111.05 31.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.419 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.6 HG11 ' HE2' ' A' ' 83' ' ' LYS . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.443 HD21 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.558 ' HE3' ' HG2' ' A' ' 83' ' ' LYS . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.78 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.491 ' HG3' ' H ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.553 ' OG ' ' HG2' ' A' ' 78' ' ' PRO . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.56 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.78 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.507 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.806 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.806 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.761 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD11 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.727 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.727 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.463 HG11 HG13 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.412 ' HD2' HD12 ' A' ' 54' ' ' LEU . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.761 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? -74.7 -14.53 60.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.1 mmm180 -83.31 6.08 21.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.527 168.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.664 HD23 HG22 ' A' ' 14' ' ' VAL . 29.5 tp -112.28 -56.99 2.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.928 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -90.41 136.91 32.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.058 174.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.607 ' HB2' ' HG3' ' A' ' 10' ' ' GLN . 0.2 OUTLIER -75.39 57.18 0.89 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.289 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.6 46.71 82.99 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.98 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -131.76 -129.94 3.09 Favored Glycine 0 N--CA 1.434 -1.449 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.048 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 48.6 tt0 -76.6 75.51 3.29 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.805 0.812 . . . . 0.0 110.016 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.928 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 2.6 p -101.01 103.26 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.974 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.517 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 67.0 t30 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.519 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.611 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.519 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.583 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.722 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 4.9 t -135.48 -46.58 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 1.029 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 65.9 mttm -70.51 -62.67 1.99 Allowed Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -157.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 50.5 Cg_exo -58.46 -9.1 6.26 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 123.188 2.592 . . . . 0.0 113.836 -177.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.722 ' HE2' ' HA ' ' A' ' 76' ' ' VAL . 48.9 mtmt -73.22 -50.41 22.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.067 0.461 . . . . 0.0 110.595 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 174.61 26.82 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.084 -0.806 . . . . 0.0 111.084 -174.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 77' ' ' LYS . . . -124.53 -178.78 4.24 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -116.25 167.53 10.93 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.597 0.713 . . . . 0.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 1.029 ' HA ' ' HD3' ' A' ' 77' ' ' LYS . 1.4 mtpm? -82.69 -26.12 32.36 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.835 -167.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 67.07 -60.25 0.37 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.243 0.965 . . . . 0.0 110.728 -174.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 55.4 t80 69.45 112.46 0.05 OUTLIER 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.493 0.717 . . . . 0.0 111.545 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.1 p 54.91 85.67 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.522 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 163.29 -142.46 7.88 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 119.9 -1.143 . . . . 0.0 113.605 175.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -49.33 125.58 11.29 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.814 0.846 . . . . 0.0 112.808 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.03 -25.73 17.64 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.804 176.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -97.58 151.5 20.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.812 0.339 . . . . 0.0 110.953 -177.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 95' ' ' THR . 78.4 tttt -73.21 -45.87 53.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.289 175.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 32.1 tp 68.1 4.23 4.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.257 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.531 ' H ' ' HG2' ' A' ' 91' ' ' LYS . . . 85.85 -13.81 55.0 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.987 -0.552 . . . . 0.0 112.003 -176.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 18.8 m -85.23 -51.64 6.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.164 -177.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 62.2 m -99.71 99.41 10.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.122 0.486 . . . . 0.0 111.442 -175.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -89.6 114.45 60.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.832 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.648 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 79.2 Cg_endo -79.04 51.53 3.9 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 122.68 2.253 . . . . 0.0 112.175 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 57.12 -92.17 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.128 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.94 15.59 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.483 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.648 ' HB2' ' HB2' ' A' ' 97' ' ' PRO . 30.6 mt -67.07 -69.42 0.31 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.089 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.413 ' H ' ' HG2' ' A' ' 97' ' ' PRO . 11.7 m -82.91 -107.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 171.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.3 m . . . . . 0 C--O 1.246 0.911 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 172.085 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -76.58 65.29 2.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.612 -177.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 4' ' ' LYS . 10.2 pt-20 -95.32 -18.85 20.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.307 0.575 . . . . 0.0 109.608 173.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 3' ' ' GLU . 64.0 mttm -102.3 89.43 3.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.931 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -139.44 -72.67 0.38 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.554 ' HG3' ' H ' ' A' ' 8' ' ' SER . 23.5 tp60 64.33 114.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 124.048 0.842 . . . . 0.0 111.609 177.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -76.39 18.27 0.32 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.626 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.554 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.9 m -94.89 -20.22 19.6 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 169.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -91.26 52.85 2.19 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.736 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -108.12 51.85 0.73 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.445 ' CB ' ' HB3' ' A' ' 62' ' ' GLN . 5.6 p-10 -49.04 142.86 6.23 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.229 175.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.573 HG22 ' HB2' ' A' ' 58' ' ' ALA . 22.3 m -124.49 133.36 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-O 121.6 0.714 . . . . 0.0 109.802 174.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.54 ' HE1' ' HA ' ' A' ' 94' ' ' SER . 15.5 t-80 -104.77 100.89 10.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 171.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.563 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m -103.5 122.29 55.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 -173.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.689 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.918 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' N ' HD23 ' A' ' 16' ' ' LEU . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.831 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.918 ' HB2' HD21 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.521 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.831 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.647 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.667 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.659 HD21 HD12 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.559 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? -66.67 -34.33 77.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 31.1 mmt180 -86.57 33.74 0.64 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.225 0.536 . . . . 0.0 110.14 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.8 tt -139.19 -60.21 0.57 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 174.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HG22 ' A' ' 12' ' ' VAL . . . -63.06 164.7 8.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.15 166.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.93 27.95 0.37 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.603 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 66.23 20.9 69.71 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.616 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.06 -120.12 4.12 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.034 -1.079 . . . . 0.0 111.181 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.445 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 37.0 tt0 -65.98 83.86 0.08 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.483 0.659 . . . . 0.0 110.778 172.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' HB3' ' A' ' 58' ' ' ALA . 5.2 m -92.14 101.22 12.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.855 HD11 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.473 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.639 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.737 ' HB2' HD12 ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m -89.88 84.95 2.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.527 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 5.7 ptpt -83.13 155.4 67.12 Favored Pre-proline 0 C--N 1.313 -0.993 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.352 -174.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -66.07 -40.33 16.19 Favored 'Trans proline' 0 CA--C 1.52 -0.184 0 C-N-CA 122.887 2.391 . . . . 0.0 110.788 172.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -52.13 -72.53 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.062 -1.426 . . . . 0.0 113.157 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.511 ' H ' ' HG3' ' A' ' 77' ' ' LYS . . . -100.72 -23.16 10.26 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.685 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -87.49 -48.94 7.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.353 0.576 . . . . 0.0 110.18 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 66.24 15.91 10.25 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.71 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -138.82 72.32 1.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.587 0.708 . . . . 0.0 111.103 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.29 71.19 10.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 173.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -89.48 28.75 1.22 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.837 -169.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.0 t -156.35 151.46 26.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.926 -0.484 . . . . 0.0 111.245 -177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.535 ' HA3' ' CD ' ' A' ' 90' ' ' GLN . . . 106.02 91.85 2.24 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.773 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -72.93 -60.54 2.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.673 0.273 . . . . 0.0 111.29 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.34 42.81 2.21 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.072 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.535 ' CD ' ' HA3' ' A' ' 87' ' ' GLY . 36.9 mt-30 -123.39 -16.44 6.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.896 0.379 . . . . 0.0 110.154 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.68 -79.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.674 -176.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 92' ' ' LEU . 3.5 mm? 57.65 -91.12 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 122.774 0.429 . . . . 0.0 111.779 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -108.14 -7.17 31.16 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.263 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.54 ' HA ' ' HE1' ' A' ' 13' ' ' HIS . 13.9 t -65.53 -26.62 67.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.79 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 p -105.4 19.65 20.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.73 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . -102.98 105.72 46.99 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.512 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 7.8 Cg_exo -73.68 -18.11 22.57 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.078 2.519 . . . . 0.0 112.876 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -139.86 121.19 14.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.583 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 14.8 p -83.66 -20.44 9.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.722 173.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.88 -50.86 25.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.32 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.7 m -114.82 106.41 14.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.885 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.616 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 p 46.25 37.98 4.59 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.665 0.786 . . . . 0.0 111.768 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.22 140.77 58.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.913 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HE3' ' HB3' ' A' ' 4' ' ' LYS . 18.7 mtpp -72.39 93.72 1.56 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.708 0.766 . . . . 0.0 111.198 -174.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -133.95 -60.69 0.81 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.523 -1.217 . . . . 0.0 108.047 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 46.16 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.472 1.108 . . . . 0.0 113.949 168.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.46 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 73.0 m-70 -96.36 13.05 29.02 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -171.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.8 m -78.73 60.01 2.67 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.816 ' HB2' ' H ' ' A' ' 60' ' ' GLY . 3.9 m -100.75 -16.95 17.16 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.539 -173.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.679 ' HG2' ' HG2' ' A' ' 55' ' ' ARG . 9.5 mt-30 85.6 44.49 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 167.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.686 ' N ' ' HB1' ' A' ' 58' ' ' ALA . 7.7 t70 -110.36 116.72 31.95 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.6 1.091 . . . . 0.0 111.339 171.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.465 HG13 ' CB ' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -154.34 143.66 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 O-C-N 123.578 0.549 . . . . 0.0 110.812 177.017 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 -103.25 99.61 9.47 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 167.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.404 ' HA ' ' HB2' ' A' ' 26' ' ' ASP . 32.0 t -106.22 103.71 15.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 -172.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.882 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.466 ' HD2' ' HD2' ' A' ' 77' ' ' LYS . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.587 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.882 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.556 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.64 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.403 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.777 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.587 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.683 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.777 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.817 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HD11 ' A' ' 54' ' ' LEU . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.817 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.442 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.679 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -66.49 -39.53 88.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.3 mmt180 -85.29 24.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.145 -0.347 . . . . 0.0 111.467 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -139.53 -42.72 0.45 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.686 ' HB1' ' N ' ' A' ' 11' ' ' ASP . . . -52.19 142.48 16.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.35 -1.295 . . . . 0.0 113.107 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.511 ' N ' ' H ' ' A' ' 11' ' ' ASP . 7.4 p80 -141.51 106.53 4.95 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.271 0.558 . . . . 0.0 112.243 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.816 ' H ' ' HB2' ' A' ' 9' ' ' SER . . . 151.39 -41.65 0.75 Allowed Glycine 0 C--N 1.331 0.255 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -178.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.52 ' H ' ' N ' ' A' ' 11' ' ' ASP . . . 107.19 18.6 10.23 Favored Glycine 0 CA--C 1.512 -0.142 0 N-CA-C 114.287 0.475 . . . . 0.0 114.287 174.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.551 ' HB3' ' OD1' ' A' ' 11' ' ' ASP . 57.4 tt0 -114.05 75.18 0.91 Allowed 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 169.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.404 HG23 ' CG2' ' A' ' 12' ' ' VAL . 7.4 p -91.56 102.81 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.892 ' HB2' HD12 ' A' ' 30' ' ' LEU . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.583 HG23 ' HD2' ' A' ' 82' ' ' PHE . 7.2 p -165.42 80.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.649 ' CB ' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -146.05 -79.94 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 168.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.749 ' HD2' ' CZ ' ' A' ' 75' ' ' PHE . 55.8 Cg_exo -56.8 -35.82 98.29 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.069 2.512 . . . . 0.0 112.606 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.401 ' HE3' ' HB3' ' A' ' 79' ' ' LYS . 26.7 mtpp -34.69 -56.44 0.54 Allowed 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.433 1.083 . . . . 0.0 112.337 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -179.1 38.2 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 66.73 -78.53 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.67 . . . . 0.0 110.569 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.583 ' HD2' HG23 ' A' ' 76' ' ' VAL . 12.5 m-85 57.51 -92.73 0.04 OUTLIER 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.362 0.665 . . . . 0.0 110.175 -176.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -97.08 -74.18 0.58 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.453 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.3 -80.38 0.02 OUTLIER 'General case' 0 C--O 1.233 0.229 0 O-C-N 124.026 0.828 . . . . 0.0 109.608 -169.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -166.36 116.97 0.97 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.6 p -103.18 -17.38 15.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.2 -173.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 133.7 25.91 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.428 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 0.5 OUTLIER -93.58 123.02 36.62 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.514 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -57.69 116.45 8.17 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.742 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -68.99 120.62 15.15 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 25.3 tptp 67.87 21.38 9.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.621 0.724 . . . . 0.0 110.562 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 41.8 tp -87.71 63.74 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 0.0 109.526 176.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 89.96 130.59 4.25 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.942 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -68.22 115.2 7.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.003 0.43 . . . . 0.0 110.947 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.1 p -80.33 74.01 7.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.765 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.71 90.46 48.24 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.552 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.707 ' HG2' ' HB3' ' A' ' 100' ' ' LEU . 59.6 Cg_endo -74.18 91.04 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.354 2.036 . . . . 0.0 111.523 173.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 70.0 -80.48 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.275 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -135.82 18.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.442 . . . . 0.0 111.391 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.743 ' HG ' ' H ' ' A' ' 101' ' ' SER . 12.6 tp -122.08 -176.48 3.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.216 -178.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.743 ' H ' ' HG ' ' A' ' 100' ' ' LEU . 69.4 m -130.25 103.98 7.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.717 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.425 ' HB ' ' O ' ' A' ' 101' ' ' SER . 12.6 t . . . . . 0 C--O 1.248 1.004 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t 66.73 36.39 4.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.56 0.695 . . . . 0.0 110.218 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -163.98 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.582 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -138.31 43.92 2.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 111.003 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -131.15 -68.33 0.67 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.249 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -144.22 110.32 5.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.375 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -85.21 31.1 0.57 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.819 0.342 . . . . 0.0 111.143 -173.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.1 m -87.88 38.4 0.84 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.731 0.3 . . . . 0.0 111.082 -176.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -153.09 41.99 0.58 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.2 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -77.45 -43.05 33.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.553 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 6.3 m-20 52.2 88.78 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.057 0.848 . . . . 0.0 112.051 174.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.981 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -66.2 111.9 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 CA-C-O 121.552 0.691 . . . . 0.0 112.102 -175.213 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -101.11 101.91 12.75 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 162.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 54' ' ' LEU . 36.0 t -103.16 108.74 25.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.779 -166.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.556 ' HD2' ' HB2' ' A' ' 77' ' ' LYS . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.742 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.43 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.727 ' HB2' HD21 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.742 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.406 HD12 ' N ' ' A' ' 25' ' ' LEU . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.565 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.572 HD13 ' HD1' ' A' ' 19' ' ' TRP . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.445 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.79 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.79 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.598 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.579 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.579 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.716 HG13 HD12 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.716 HD12 HG13 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -73.08 -45.0 59.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 56' ' ' ARG . 14.4 mmt180 -85.75 38.0 0.73 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.214 0.53 . . . . 0.0 110.168 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.43 -59.27 0.77 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.981 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -75.34 139.94 42.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.471 174.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -98.51 129.79 45.09 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.273 172.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 140.25 -42.29 1.22 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.649 -177.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 114.72 -29.25 7.62 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.203 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -60.38 118.33 6.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.451 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.734 ' HA ' HG23 ' A' ' 12' ' ' VAL . 6.5 m -131.18 104.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.489 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.463 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.675 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.757 ' CE2' ' HE2' ' A' ' 79' ' ' LYS . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' HG13 ' A' ' 76' ' ' VAL . 5.6 p -146.59 86.26 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.863 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -131.33 -55.05 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.228 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.863 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 2.8 Cg_exo -82.52 -127.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.965 3.11 . . . . 0.0 110.094 170.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.757 ' HE2' ' CE2' ' A' ' 75' ' ' PHE . 73.7 mmtt 64.16 -80.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.864 0.466 . . . . 0.0 112.104 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 154.16 -85.15 0.14 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -177.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.38 155.44 40.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -90.03 102.11 14.82 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.327 -173.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 75' ' ' PHE . 20.8 ptmt -90.95 19.84 5.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.335 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.434 ' HA ' ' HG3' ' A' ' 73' ' ' GLU . . . -56.16 111.81 1.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.294 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.722 ' HE2' ' HG2' ' A' ' 88' ' ' GLU . 52.0 t80 -94.54 -84.55 0.32 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.001 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.414 ' H ' ' HA ' ' A' ' 73' ' ' GLU . 97.1 m 69.81 137.3 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.291 0.567 . . . . 0.0 111.161 -173.445 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 128.71 6.89 4.43 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.595 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.722 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 8.5 mm-40 -120.15 1.97 10.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.798 0.333 . . . . 0.0 111.399 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -159.7 -47.32 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.27 -0.966 . . . . 0.0 113.033 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -80.8 -1.48 43.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.94 0.4 . . . . 0.0 111.062 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -33.15 68.83 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 169.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.7 mt 59.83 -74.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.66 -150.49 5.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.164 -0.541 . . . . 0.0 112.558 -178.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 p 50.55 62.76 2.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.403 0.621 . . . . 0.0 111.222 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.5 p -130.24 173.82 10.42 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.503 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -104.29 104.23 43.21 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.727 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.29 -21.27 15.5 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.752 2.301 . . . . 0.0 112.559 -178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -145.86 -159.81 1.06 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.546 HG23 HD12 ' A' ' 100' ' ' LEU . 18.3 m -61.36 -24.03 32.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.781 0.324 . . . . 0.0 111.16 175.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.546 HD12 HG23 ' A' ' 99' ' ' VAL . 11.1 mp -93.3 135.8 34.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.9 p -85.75 23.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -170.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.245 178.392 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 112.124 -0.39 . . . . 0.0 112.124 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 34.53 16.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.394 0.616 . . . . 0.0 110.123 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.39 124.58 13.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.332 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -74.09 88.64 1.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -75.82 162.3 28.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.851 0.834 . . . . 0.0 112.487 -172.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.22 -167.73 2.91 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.263 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -87.3 48.27 1.62 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.432 0.634 . . . . 0.0 110.059 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.7 p -96.07 4.03 52.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.046 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 m -81.74 53.88 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.181 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -94.24 22.05 6.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.645 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 63.0 174.29 0.15 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.27 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.949 ' HB ' ' HA ' ' A' ' 63' ' ' VAL . 2.2 t -123.29 102.33 11.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.436 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -112.46 103.08 11.16 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 172.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 26' ' ' ASP . 1.9 m -115.47 113.57 43.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 -173.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.728 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.876 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.618 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.595 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.553 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' OD1' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.572 ' HB3' HG12 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.497 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 3.0 p-10 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.595 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.54 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.595 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.853 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.716 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.608 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.853 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.608 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.563 ' HD3' ' HA3' ' A' ' 60' ' ' GLY . 2.5 tmt_? -67.93 -55.32 13.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -86.02 38.62 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.163 0.506 . . . . 0.0 111.025 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 1.5 tm? -117.93 -52.52 2.42 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.553 ' CB ' HG22 ' A' ' 12' ' ' VAL . . . -84.03 -174.11 5.1 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.179 -1.373 . . . . 0.0 109.69 166.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -62.97 -23.32 67.36 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.069 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.563 ' HA3' ' HD3' ' A' ' 55' ' ' ARG . . . 89.46 27.67 21.85 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.353 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.99 -102.22 0.33 Allowed Glycine 0 CA--C 1.506 -0.523 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.646 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -76.48 87.08 3.21 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 115.221 -0.489 . . . . 0.0 109.952 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.949 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.2 t -89.67 102.54 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.488 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.526 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.696 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 76' ' ' VAL . 7.0 p -173.13 96.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.819 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.8 OUTLIER -141.02 -62.62 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.678 169.69 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 25.8 Cg_exo -66.58 -42.55 9.23 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 122.757 2.305 . . . . 0.0 111.362 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -65.93 -4.34 6.81 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.708 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -135.06 39.83 1.64 Allowed Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 177.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 65.14 -79.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.665 0.786 . . . . 0.0 111.076 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.42 -5.48 0.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.768 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm 50.59 93.27 0.02 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.928 -171.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -49.79 133.64 21.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 170.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -72.17 64.35 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.842 0.83 . . . . 0.0 112.577 -167.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -149.67 76.0 1.29 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.31 101.07 1.96 Allowed Glycine 0 N--CA 1.443 -0.898 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.581 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.13 -41.41 79.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -100.95 47.88 1.18 Allowed Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -129.68 -75.52 0.55 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.175 -178.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -108.2 -13.2 14.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.401 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 92' ' ' LEU . 27.6 tp 64.49 28.68 13.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.932 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.34 1.73 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.625 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m -86.45 -20.39 28.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.877 0.37 . . . . 0.0 110.614 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.0 m -108.88 84.81 1.99 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.2 0.524 . . . . 0.0 110.225 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -162.79 86.94 1.37 Allowed Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.846 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -62.86 -72.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.764 2.309 . . . . 0.0 112.523 -178.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -176.57 -89.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 13.2 t 49.83 -96.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 123.613 0.765 . . . . 0.0 112.284 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.8 tp -168.42 -67.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.6 m -99.13 -178.41 3.92 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.016 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.331 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 t -142.42 149.23 39.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.055 0.455 . . . . 0.0 110.594 -176.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -100.08 -13.15 19.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.023 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt 55.03 73.57 0.41 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.722 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -101.38 169.78 8.66 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.889 -176.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -125.93 -63.84 1.09 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -157.67 -37.97 0.07 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.129 174.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 64.3 m 65.48 3.12 2.24 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 170.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 m -140.3 39.72 1.91 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.216 0.531 . . . . 0.0 110.644 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -87.26 -24.33 24.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.501 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 p30 55.74 161.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.608 1.163 . . . . 0.0 113.536 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.89 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -116.56 112.26 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.441 169.696 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -103.89 101.37 11.17 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.802 HG11 HD22 ' A' ' 54' ' ' LEU . 13.1 m -108.04 106.45 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 -172.411 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.776 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HE2' ' HE2' ' A' ' 77' ' ' LYS . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.847 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.504 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.776 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.45 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.717 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.472 ' OD1' HD12 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.866 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.486 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.646 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.737 HG23 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.646 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.802 HD22 HG11 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 55' ' ' ARG . 1.4 tpp180 -62.48 -56.29 19.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 56' ' ' ARG . 19.9 tpt180 -82.76 50.76 1.75 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.868 0.842 . . . . 0.0 110.248 174.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 40.9 tp -141.92 -57.62 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.565 169.221 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.89 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -63.93 142.73 58.3 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.757 175.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -94.57 99.43 11.58 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 152.5 -40.65 0.72 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.096 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.15 -1.57 67.64 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.741 . . . . 0.0 113.201 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 47.6 tt0 -79.84 115.09 19.24 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.737 HG11 HG23 ' A' ' 50' ' ' VAL . 54.5 t -122.83 115.26 45.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.518 -174.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.437 HD11 HD12 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.679 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.866 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.424 HG13 ' HB1' ' A' ' 84' ' ' ALA . 7.3 p -163.89 120.26 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.772 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 28.1 ttmt -173.33 -70.81 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.432 170.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.772 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 32.2 Cg_exo -62.64 -40.03 40.12 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.307 2.004 . . . . 0.0 109.9 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.413 ' O ' ' HG3' ' A' ' 79' ' ' LYS . 13.9 ptmm? -97.61 74.01 2.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.461 -1.245 . . . . 0.0 110.2 172.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -140.3 -169.57 11.74 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.678 -0.773 . . . . 0.0 111.508 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -89.66 -60.48 1.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -154.5 -63.52 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.155 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -105.71 103.24 12.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.525 0.678 . . . . 0.0 110.314 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.424 ' HB1' HG13 ' A' ' 76' ' ' VAL . . . -84.41 50.74 1.94 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.617 -175.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -174.28 136.94 0.5 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.101 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.8 m -92.0 -29.12 16.78 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.44 -57.39 5.03 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.802 176.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -77.31 147.86 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.029 0.442 . . . . 0.0 111.627 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.2 -0.48 56.0 Favored Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.822 -0.626 . . . . 0.0 113.755 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -118.65 -44.7 2.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.508 0.654 . . . . 0.0 111.583 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -108.04 -17.67 13.98 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 71.65 -50.99 0.69 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.775 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 130.41 130.39 3.2 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.346 174.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 p -105.02 34.82 3.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.624 0.726 . . . . 0.0 109.358 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.0 p -76.2 -47.41 24.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.799 -1.092 . . . . 0.0 112.443 -172.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.46 117.18 68.21 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.904 -173.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.59 126.82 13.16 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 123.039 2.492 . . . . 0.0 110.986 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 63.86 -78.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.292 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 13.5 p -155.84 -26.18 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.921 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.6 tp -82.49 160.46 22.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.624 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -63.7 -49.96 71.09 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.261 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.266 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.309 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.594 -0.602 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -155.66 121.55 5.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.875 0.369 . . . . 0.0 110.859 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -96.44 -3.92 42.59 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 tttt 64.51 37.54 7.97 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.442 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 6' ' ' GLN . 15.6 mmm180 -94.69 -176.95 4.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.098 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' HB3' ' O ' ' A' ' 5' ' ' ARG . 54.0 tt0 73.95 125.89 0.04 OUTLIER 'General case' 0 C--O 1.235 0.303 0 O-C-N 123.794 0.684 . . . . 0.0 110.522 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -78.57 74.34 5.1 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.633 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 62' ' ' GLN . 16.3 m -85.88 52.78 2.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.84 -172.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.1 p -104.99 22.12 15.85 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.695 0.759 . . . . 0.0 110.056 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -63.24 -35.05 79.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.977 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.888 ' HA ' ' HA ' ' A' ' 62' ' ' GLN . 19.9 t70 66.97 126.89 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.983 0.913 . . . . 0.0 112.507 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 62' ' ' GLN . 9.0 m -122.19 166.94 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.281 -178.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -112.98 122.96 49.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.02 0.438 . . . . 0.0 110.527 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.814 HG11 HD22 ' A' ' 54' ' ' LEU . 98.8 t -101.92 106.51 19.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.861 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.901 ' HG2' ' HD3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.488 HD21 ' HD2' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.736 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.68 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.577 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.544 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.736 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.68 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.671 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.671 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.652 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.541 HG11 HG13 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.652 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.814 HD22 HG11 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -66.44 -32.2 73.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 23.1 mmm180 -85.46 36.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.115 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.4 tt -147.53 -59.92 0.27 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.988 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -89.86 142.24 27.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.613 177.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -100.2 142.14 32.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.784 -168.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.03 -6.45 3.9 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.554 0.581 . . . . 0.0 114.554 170.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' VAL . . . 114.63 9.63 14.14 Favored Glycine 0 CA--C 1.504 -0.636 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.642 -175.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.888 ' HA ' ' HA ' ' A' ' 11' ' ' ASP . 26.5 tt0 -67.02 43.25 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.857 0.863 . . . . 0.0 109.827 170.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.988 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 7.4 p -153.21 124.17 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 -172.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.494 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.4 ' HG2' HE22 ' A' ' 90' ' ' GLN . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HD2' HD21 ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.665 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.664 ' CE1' ' HD2' ' A' ' 78' ' ' PRO . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -166.46 -14.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HD3' ' HG2' ' A' ' 17' ' ' LYS . 23.3 mtpp -83.73 -70.0 0.14 Allowed Pre-proline 0 CA--C 1.542 0.672 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -168.271 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 17.3 Cg_exo -71.77 47.39 0.94 Allowed 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.947 2.431 . . . . 0.0 113.344 175.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 79' ' ' LYS . 32.6 mtpt -115.81 -15.32 11.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.676 0.274 . . . . 0.0 111.517 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 117.71 -52.7 0.68 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.966 175.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.24 152.22 34.06 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -113.87 73.81 0.84 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.5 0.667 . . . . 0.0 111.309 -176.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -120.75 -7.3 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.825 ' HB1' ' HG2' ' A' ' 77' ' ' LYS . . . -65.93 115.74 6.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.198 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -76.78 174.46 10.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.096 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.3 t -161.28 105.89 1.32 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.293 0.568 . . . . 0.0 112.035 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.39 -77.21 1.23 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.934 170.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -76.75 72.94 3.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.152 0.501 . . . . 0.0 111.138 -175.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.32 103.09 1.9 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.891 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.4 HE22 ' HG2' ' A' ' 68' ' ' GLU . 15.0 mm-40 -92.74 -35.12 13.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.969 0.414 . . . . 0.0 110.047 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -168.58 103.69 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.626 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 47.8 tp -114.94 -23.5 9.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.577 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 169.68 129.02 1.06 Allowed Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.652 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.7 t -102.57 36.44 2.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.9 0.381 . . . . 0.0 110.508 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -33.04 74.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.089 0.471 . . . . 0.0 110.711 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.65 96.02 41.66 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.133 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -56.14 -56.49 2.08 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.41 2.74 . . . . 0.0 112.831 -176.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.435 ' HG3' HG12 ' A' ' 99' ' ' VAL . 5.1 tp-100 179.35 -82.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.896 0.379 . . . . 0.0 110.233 177.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.435 HG12 ' HG3' ' A' ' 98' ' ' GLN . 8.7 p -163.05 -29.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.273 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 tp -54.91 -74.98 0.04 OUTLIER 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.139 0.495 . . . . 0.0 110.694 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -94.0 57.44 2.42 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.223 0.535 . . . . 0.0 109.606 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.119 -178.291 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -120.91 -47.87 2.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.963 0.382 . . . . 0.0 109.995 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.638 ' HG3' ' H ' ' A' ' 4' ' ' LYS . 3.0 pt-20 -57.24 -46.34 83.09 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.638 ' H ' ' HG3' ' A' ' 3' ' ' GLU . 36.7 mtmm -118.3 79.83 1.44 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.845 172.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 tpp85 -51.59 -44.73 62.89 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.641 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -177.36 -74.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.461 173.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 176.91 134.57 0.06 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.48 -1.236 . . . . 0.0 107.838 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 19.6 m 61.25 73.89 0.46 Allowed 'General case' 0 C--N 1.327 -0.371 0 O-C-N 123.706 0.629 . . . . 0.0 110.823 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 p -134.06 -2.49 2.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.873 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 96.4 mt-30 -96.84 4.18 51.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.8 m-20 49.43 -157.86 0.08 Allowed 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.695 0.622 . . . . 0.0 112.028 173.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.52 ' CG1' ' HA ' ' A' ' 58' ' ' ALA . 10.9 p -162.61 139.18 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.701 0.763 . . . . 0.0 112.355 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 11.9 m80 -111.88 105.07 13.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.384 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m -103.93 136.37 37.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.667 ' HE3' ' HB2' ' A' ' 77' ' ' LYS . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.522 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.867 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.495 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.661 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.542 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.454 ' HB3' HG12 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.854 ' HB3' HD12 ' A' ' 57' ' ' LEU . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.416 ' HD3' ' HB3' ' A' ' 38' ' ' ASN . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.661 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.834 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.834 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.748 HG11 HH21 ' A' ' 55' ' ' ARG . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.54 ' HD2' HD11 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.689 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.748 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 -78.17 -32.92 50.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -77.89 -3.16 40.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.671 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.854 HD12 ' HB3' ' A' ' 27' ' ' ASN . 1.1 tt -104.34 -34.64 8.23 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 172.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.52 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . . . -57.83 120.82 9.12 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.406 1.098 . . . . 0.0 111.481 175.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.641 ' O ' ' HB3' ' A' ' 8' ' ' SER . 35.8 m80 -88.4 -70.34 0.65 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.389 -176.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.554 ' HA2' ' O ' ' A' ' 8' ' ' SER . . . -68.45 -32.83 75.85 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.385 -177.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.82 -21.46 5.59 Favored Glycine 0 CA--C 1.499 -0.946 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.444 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 44.3 tt0 -72.51 90.89 1.36 Allowed 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.002 -0.599 . . . . 0.0 109.631 171.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.746 HG11 HG21 ' A' ' 50' ' ' VAL . 3.6 p -94.81 102.67 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 174.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.457 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.535 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -159.84 99.85 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.881 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 17.5 ttpp -162.09 -69.82 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 163.039 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.881 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 22.4 Cg_exo -68.89 -38.92 9.06 Favored 'Trans proline' 0 N--CA 1.475 0.437 0 C-N-CA 123.074 2.516 . . . . 0.0 112.534 -175.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -49.46 -44.31 45.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.308 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -178.92 33.29 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 61.42 -79.62 0.02 OUTLIER 'General case' 0 C--O 1.235 0.338 0 O-C-N 124.171 0.571 . . . . 0.0 110.439 -172.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.791 ' HD2' ' HG2' ' A' ' 83' ' ' LYS . 16.8 t80 66.9 -70.57 0.11 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.948 0.899 . . . . 0.0 110.682 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.791 ' HG2' ' HD2' ' A' ' 82' ' ' PHE . 21.2 pttp -159.03 65.41 0.41 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.487 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.09 67.1 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -146.3 129.99 17.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.6 t -130.07 -49.27 1.11 Allowed 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.644 -174.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.8 -49.0 2.39 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.58 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -53.68 -51.2 63.97 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.051 0.54 . . . . 0.0 110.898 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -102.89 28.64 14.96 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.473 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -126.15 -66.43 0.93 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.312 0.577 . . . . 0.0 109.851 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.435 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.2 ttpp -161.51 90.34 0.79 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.68 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 92' ' ' LEU . 1.9 tm? -66.64 -39.65 88.34 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -139.69 -83.23 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.111 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.4 p -151.21 -62.17 0.18 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.64 0.257 . . . . 0.0 110.584 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m 60.18 55.65 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.997 0.903 . . . . 0.0 109.496 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB1' ' HA ' ' A' ' 101' ' ' SER . . . -141.07 71.87 27.87 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.674 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.6 -67.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -151.33 149.92 29.91 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.3 t 70.4 -58.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 O-C-N 123.985 0.803 . . . . 0.0 110.529 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.426 ' N ' HD12 ' A' ' 100' ' ' LEU . 5.5 mp -79.58 116.72 19.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 174.223 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.475 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . 36.6 t -126.32 126.62 44.24 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.036 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HD2' ' A' ' 91' ' ' LYS . 23.5 m . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.188 178.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.383 -0.287 . . . . 0.0 112.383 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -177.72 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.152 0.501 . . . . 0.0 109.687 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -137.11 -27.29 0.98 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.27 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.23 84.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 171.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 19.9 mmm180 -95.51 -175.83 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.098 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 62.64 -171.44 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.797 0.686 . . . . 0.0 111.236 -177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -140.49 142.1 35.31 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 173.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.432 ' HB3' HG11 ' A' ' 12' ' ' VAL . 3.1 t -51.63 120.06 4.81 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.572 0.545 . . . . 0.0 109.893 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.537 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 66.7 m -134.72 46.8 2.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.843 -171.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -143.81 52.3 1.32 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 63.77 105.01 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 O-C-N 123.734 0.646 . . . . 0.0 109.862 -176.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.519 HG22 ' HB2' ' A' ' 58' ' ' ALA . 2.1 m -118.59 165.58 13.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -161.375 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -114.17 116.66 29.44 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.732 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t -104.85 151.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.933 HG13 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.629 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.933 ' HE3' HG13 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.959 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.629 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.6 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.512 ' N ' HD22 ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 15' ' ' VAL . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.639 ' HB3' ' HG ' ' A' ' 57' ' ' LEU . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.959 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.663 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.605 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.787 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.787 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.524 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.695 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.532 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.627 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -64.65 -42.06 95.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 56' ' ' ARG . 8.6 mmt180 -86.36 26.37 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.639 ' HG ' ' HB3' ' A' ' 27' ' ' ASN . 2.9 tm? -124.81 -43.74 1.98 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 174.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.519 ' HB2' HG22 ' A' ' 12' ' ' VAL . . . -79.09 136.26 37.1 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.045 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 9' ' ' SER . 1.0 OUTLIER -107.71 138.78 43.33 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.502 173.389 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.1 -32.17 7.47 Favored Glycine 0 N--CA 1.445 -0.756 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -174.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.24 -24.66 24.06 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.781 176.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 46.9 tt0 -75.1 95.43 3.07 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.333 0.587 . . . . 0.0 109.888 178.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p -116.51 105.15 17.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.273 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.559 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.596 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.477 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 84' ' ' ALA . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.859 ' HB2' HD12 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.505 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 4.5 p -160.77 -21.95 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.709 ' HB2' ' HD3' ' A' ' 78' ' ' PRO . 6.4 mmmt -62.19 -65.17 2.31 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -170.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 72.9 Cg_exo -56.48 -36.08 97.25 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.269 2.646 . . . . 0.0 113.299 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.549 ' HE3' ' CD2' ' A' ' 75' ' ' PHE . 95.1 mttt -48.93 -59.16 3.83 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.539 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 141.06 -156.68 25.67 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.31 -43.52 0.55 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.494 0.718 . . . . 0.0 111.914 178.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 57.56 58.13 3.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 111.691 175.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -104.07 -7.17 20.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.374 172.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.553 ' HA ' ' OE2' ' A' ' 73' ' ' GLU . . . -56.81 128.18 35.37 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.929 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -87.46 82.17 7.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.252 0.549 . . . . 0.0 110.611 -174.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.3 m -80.03 82.74 6.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.066 176.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -155.61 178.66 32.09 Favored Glycine 0 N--CA 1.445 -0.767 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.438 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -86.65 -39.83 15.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.302 0.573 . . . . 0.0 110.031 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.462 ' HA2' HD11 ' A' ' 92' ' ' LEU . . . -80.44 44.58 2.92 Favored Glycine 0 C--O 1.227 -0.292 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.847 -177.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.8 136.09 33.3 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt 74.99 -42.21 0.48 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 111.699 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.462 HD11 ' HA2' ' A' ' 89' ' ' GLY . 4.5 pp -75.63 -14.36 60.37 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.308 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -136.59 132.78 6.2 Favored Glycine 0 N--CA 1.438 -1.209 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.123 172.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.4 p -164.16 -37.41 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.995 0.398 . . . . 0.0 111.153 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.2 p -67.84 -20.79 65.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.501 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.48 81.27 46.73 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.033 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.439 ' HB2' ' HA ' ' A' ' 102' ' ' THR . 46.1 Cg_exo -57.13 111.25 0.75 Allowed 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.334 2.689 . . . . 0.0 112.574 -176.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 58.63 24.45 12.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.465 178.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.9 m 40.23 36.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.197 0.999 . . . . 0.0 112.562 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -125.89 -70.32 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.631 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.9 p -152.45 -77.8 0.12 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.407 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' A' ' 97' ' ' PRO . 1.2 p . . . . . 0 C--O 1.25 1.091 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.341 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 m -74.31 124.63 26.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.863 0.363 . . . . 0.0 110.331 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.85 -3.68 45.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.182 0.515 . . . . 0.0 110.281 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -83.11 64.93 7.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.662 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 1.8 mmp_? -114.98 168.29 10.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.928 -174.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.659 ' HG3' ' H ' ' A' ' 8' ' ' SER . 8.4 tp-100 -78.98 127.93 32.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.615 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 65.4 m80 -87.01 9.8 18.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.06 -175.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.659 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.5 m 60.24 49.03 7.54 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.589 0.709 . . . . 0.0 109.63 -174.031 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.7 m -84.71 52.0 2.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.223 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -118.24 44.32 2.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.676 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.526 ' OD1' ' HD2' ' A' ' 13' ' ' HIS . 1.3 p30 53.64 -177.54 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.531 1.144 . . . . 0.0 112.559 175.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.7 p -160.83 117.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.332 168.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.526 ' HD2' ' OD1' ' A' ' 11' ' ' ASP . 63.2 m-70 -107.07 121.96 45.51 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.264 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t -103.75 116.65 47.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.846 -174.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.435 HG11 ' HG2' ' A' ' 78' ' ' PRO . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' CE ' ' HD3' ' A' ' 78' ' ' PRO . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.56 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.837 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.535 ' HB2' HD21 ' A' ' 16' ' ' LEU . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.502 ' N ' HD12 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.41 ' OE2' ' HG3' ' A' ' 79' ' ' LYS . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.528 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.404 ' HD1' HD11 ' A' ' 42' ' ' LEU . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.68 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD11 ' HD1' ' A' ' 33' ' ' TYR . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 43' ' ' GLU . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.486 ' HD2' HD11 ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.486 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? -72.5 -28.38 62.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.636 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 3.1 mmp_? -87.24 38.16 0.8 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.789 0.328 . . . . 0.0 111.279 168.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 57' ' ' LEU . 2.5 tm? -133.28 -58.86 0.89 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.18 159.79 23.21 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 168.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.615 ' HB3' ' O ' ' A' ' 7' ' ' HIS . 7.1 p-80 -71.77 34.46 0.06 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' HA2' ' HG2' ' A' ' 55' ' ' ARG . . . 74.68 16.14 80.36 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -172.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -117.07 156.03 15.84 Favored Glycine 0 N--CA 1.444 -0.789 0 CA-C-O 119.459 -0.634 . . . . 0.0 111.577 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.478 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 47.2 tt0 14.1 58.36 0.01 OUTLIER 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.264 1.426 . . . . 0.0 112.87 -166.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p -99.02 104.51 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.334 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 60.9 t30 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB2' HD12 ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m -150.41 54.94 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.94 ' HE3' ' HD2' ' A' ' 78' ' ' PRO . 9.3 ptmt -74.02 177.78 1.95 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.94 ' HD2' ' HE3' ' A' ' 77' ' ' LYS . 30.6 Cg_exo -66.06 52.28 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.172 2.581 . . . . 0.0 112.907 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HG2' ' CD ' ' A' ' 77' ' ' LYS . 16.3 mmtp -120.14 -64.5 1.25 Allowed 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.886 0.474 . . . . 0.0 110.393 174.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.16 38.53 3.21 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.392 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -161.64 -50.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.396 . . . . 0.0 109.997 -175.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 53.52 53.16 12.01 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.584 0.552 . . . . 0.0 110.821 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.493 ' HB3' ' NZ ' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -161.52 127.46 3.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.85 178.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -114.44 61.84 0.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.403 175.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -72.45 -23.09 61.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.309 -176.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.9 m -106.1 90.43 3.37 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 90' ' ' GLN . . . -99.3 -147.55 21.91 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.753 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -49.26 129.22 18.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 122.913 0.485 . . . . 0.0 112.269 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.94 38.37 2.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.677 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 87' ' ' GLY . 8.0 mt-30 -86.44 95.75 9.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.21 0.528 . . . . 0.0 111.295 -177.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.477 ' HB3' ' NZ ' ' A' ' 91' ' ' LYS . 8.8 mtpm? 60.53 30.6 19.88 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.126 177.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 54.6 tp -95.42 81.73 3.61 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 151.97 -173.67 31.14 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.999 -0.62 . . . . 0.0 111.898 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 68.6 m 67.45 5.97 4.64 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.239 0.615 . . . . 0.0 112.397 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 39.4 m 60.4 95.98 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.726 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.65 85.69 44.24 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.34 -64.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.777 2.318 . . . . 0.0 111.859 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -137.3 117.76 13.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.015 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.69 78.04 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.383 1.087 . . . . 0.0 110.298 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.1 tt -162.77 -63.92 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.483 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.6 m -78.61 -57.07 3.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.796 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.661 -179.779 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 5' ' ' ARG . 19.4 m -97.85 7.31 46.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.851 0.358 . . . . 0.0 110.385 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 70.54 -76.42 0.06 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.584 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -96.78 33.02 1.94 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.48 0.181 . . . . 0.0 111.062 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.562 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 42.0 ttm180 -61.82 -57.73 10.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.855 0.359 . . . . 0.0 111.124 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -91.56 118.95 31.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.311 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -147.72 -171.37 3.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.055 -179.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . 1.036 ' HA ' ' HA ' ' A' ' 58' ' ' ALA . 36.4 m 73.68 -57.19 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.816 0.698 . . . . 0.0 111.62 176.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 p -111.48 -7.19 14.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.999 0.428 . . . . 0.0 110.744 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 80.1 mt-30 -133.38 56.81 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.444 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 4.4 t70 75.78 151.58 0.12 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 124.111 0.882 . . . . 0.0 111.997 174.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.551 HG21 HD12 ' A' ' 57' ' ' LEU . 14.7 p -153.77 122.5 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.029 171.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -104.53 114.95 29.51 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.73 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t -101.45 125.6 55.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 -172.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.61 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.873 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.807 ' HB2' ' HD2' ' A' ' 77' ' ' LYS . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 77' ' ' LYS . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.726 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.669 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.726 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.545 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.741 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.741 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.535 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.637 ' HD2' HD12 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.73 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.728 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -76.76 -15.05 59.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.4 mmm180 -85.03 1.48 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 109.933 168.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.551 HD12 HG21 ' A' ' 12' ' ' VAL . 1.3 tm? -102.83 -57.87 1.97 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 173.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 1.036 ' HA ' ' HA ' ' A' ' 8' ' ' SER . . . -96.55 132.85 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.977 173.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.58 70.33 3.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.676 -170.51 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 60.84 43.84 98.76 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.91 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.21 -147.99 9.69 Favored Glycine 0 N--CA 1.437 -1.254 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 47.0 tt0 -71.02 77.59 0.66 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.494 0.664 . . . . 0.0 109.511 170.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.919 HG22 ' HB3' ' A' ' 58' ' ' ALA . 13.8 t -95.94 103.98 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.791 -177.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.61 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.572 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.579 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.572 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m -141.51 77.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.807 ' HD2' ' HB2' ' A' ' 24' ' ' SER . 9.6 mtpt -77.14 166.93 40.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 O-C-N 121.968 -0.458 . . . . 0.0 111.644 -175.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.553 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 38.7 Cg_exo -63.98 -11.98 29.88 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.386 2.724 . . . . 0.0 111.953 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.68 ' HG2' ' HB3' ' A' ' 77' ' ' LYS . 12.1 ptmm? -86.53 5.13 36.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.768 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -148.35 35.22 1.15 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.294 179.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -153.37 -85.31 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.477 0.18 . . . . 0.0 111.18 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -178.93 137.75 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.553 ' O ' ' HB3' ' A' ' 78' ' ' PRO . 29.5 mmtp 42.22 -93.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -175.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 171.02 -36.9 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.104 -174.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -74.07 143.86 45.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.895 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.4 m -61.28 106.19 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.454 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -93.5 86.06 1.12 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.428 -0.669 . . . . 0.0 111.428 176.828 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 73.17 -50.14 0.7 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.579 0.752 . . . . 0.0 110.556 -175.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -137.8 168.44 24.51 Favored Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 175.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -74.56 -76.8 0.13 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.091 0.446 . . . . 0.0 109.991 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.47 ' H ' HD22 ' A' ' 92' ' ' LEU . 59.4 tttm -160.21 51.93 0.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.823 0.821 . . . . 0.0 109.367 171.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.47 HD22 ' H ' ' A' ' 91' ' ' LYS . 3.1 mm? -99.37 -0.91 40.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.004 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.94 115.85 2.31 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.225 -178.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 9.8 p -86.13 43.71 1.08 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.334 0.588 . . . . 0.0 110.768 178.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -86.14 61.89 7.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.884 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 52.69 78.93 0.37 Allowed Pre-proline 0 C--O 1.236 0.364 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.159 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 98' ' ' GLN . 4.6 Cg_exo -74.39 117.8 5.11 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.918 2.412 . . . . 0.0 111.717 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 97' ' ' PRO . 96.1 mt-30 67.96 -172.01 0.19 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.583 0.552 . . . . 0.0 110.548 -178.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.76 15.75 8.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.903 0.859 . . . . 0.0 109.861 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 98' ' ' GLN . 9.4 mp -82.69 117.58 22.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.151 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.9 p 48.62 41.42 17.48 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.114 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.319 -177.837 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -129.81 36.45 4.06 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.977 0.418 . . . . 0.0 110.442 -176.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -131.11 -81.28 0.53 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.843 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.38 91.72 3.88 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -95.2 -90.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.292 -174.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -124.72 137.23 54.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.933 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -111.15 61.89 0.61 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.585 0.707 . . . . 0.0 110.385 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -100.52 21.11 13.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.247 173.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -65.36 -49.33 69.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.621 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 47.79 40.81 13.12 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -71.08 106.86 3.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.121 174.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.25 154.86 18.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.432 0.634 . . . . 0.0 112.311 -166.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.475 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 28.5 m170 -112.72 133.41 54.75 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 175.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.53 HG21 HD22 ' A' ' 54' ' ' LEU . 33.1 t -103.21 150.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 1.083 HG11 ' HG3' ' A' ' 78' ' ' PRO . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.716 ' HE3' ' HD3' ' A' ' 78' ' ' PRO . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.954 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.59 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.99 ' HB2' HD21 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.714 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.666 ' H ' HD12 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.954 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.633 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.524 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.679 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.679 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.539 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 42' ' ' LEU . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.457 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.627 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.539 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 -67.12 -36.49 82.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 5.7 mmp_? -85.34 41.1 0.87 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.457 0.646 . . . . 0.0 109.901 171.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.3 tt -148.22 -54.19 0.2 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.7 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -93.55 149.21 21.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.11 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 70.9 m80 -118.94 -166.15 1.21 Allowed 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 174.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.34 -65.98 2.66 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.235 -0.983 . . . . 0.0 111.564 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 145.89 -28.75 1.72 Allowed Glycine 0 CA--C 1.495 -1.202 0 C-N-CA 120.621 -0.799 . . . . 0.0 113.882 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -79.0 55.89 1.86 Allowed 'General case' 0 N--CA 1.44 -0.972 0 CA-C-O 121.264 0.554 . . . . 0.0 110.821 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.7 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 2.6 p -90.31 102.05 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 54.7 t30 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.601 ' HG3' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.756 ' HB2' HD12 ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.522 HG13 ' O ' ' A' ' 76' ' ' VAL . 9.2 p -134.15 94.79 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.605 ' HG3' ' HG3' ' A' ' 79' ' ' LYS . 5.5 ptpt -88.68 163.04 37.1 Favored Pre-proline 0 C--N 1.313 -1.022 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.598 -167.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 1.083 ' HG3' HG11 ' A' ' 15' ' ' VAL . 63.9 Cg_endo -77.31 -19.93 12.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.525 2.15 . . . . 0.0 110.781 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.605 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 10.9 ptpt -86.59 79.75 8.81 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.86 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 138.64 -62.91 0.56 Allowed Glycine 0 N--CA 1.445 -0.728 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.791 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.75 8.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.737 0.303 . . . . 0.0 110.597 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.6 t80 71.11 -9.76 0.83 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -64.33 -27.76 69.24 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 62.02 -165.54 0.23 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.394 0.434 . . . . 0.0 111.89 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -167.11 120.31 0.97 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.642 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 90' ' ' GLN . 20.8 p -90.36 -62.52 1.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.173 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.0 71.07 0.82 Allowed Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.861 176.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 72.47 -42.93 0.55 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.423 0.689 . . . . 0.0 111.546 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 168.4 -39.01 0.22 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 86' ' ' THR . 6.9 tt0 56.42 65.04 1.51 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.529 0.681 . . . . 0.0 111.399 172.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.0 -45.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.036 172.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.3 mt 46.48 48.01 14.0 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.926 0.766 . . . . 0.0 112.056 171.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -176.42 -129.33 1.22 Allowed Glycine 0 N--CA 1.443 -0.848 0 C-N-CA 120.682 -0.771 . . . . 0.0 111.886 -178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.5 m 57.0 42.0 26.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.602 0.715 . . . . 0.0 109.887 -177.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -75.02 111.57 10.38 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.363 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' N ' ' HD3' ' A' ' 97' ' ' PRO . . . -141.82 59.18 9.24 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.324 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.806 ' HD2' HG21 ' A' ' 102' ' ' THR . 93.2 Cg_endo -91.66 -158.75 0.07 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.026 2.484 . . . . 0.0 111.645 -177.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -119.8 83.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.39 0.614 . . . . 0.0 110.716 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.3 t -87.38 -57.91 3.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 171.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 14.3 tp -175.62 -73.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.937 -1.028 . . . . 0.0 108.6 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 p -99.89 83.71 2.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.905 175.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . 0.806 HG21 ' HD2' ' A' ' 97' ' ' PRO . 7.9 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.448 -175.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.957 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -137.6 122.76 19.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.435 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 pt-20 -172.88 -41.89 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.742 ' HB3' ' HB3' ' A' ' 7' ' ' HIS . 65.3 mmtt -92.72 112.87 24.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 174.715 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -44.75 -70.85 0.09 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.037 0.835 . . . . 0.0 112.682 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -106.85 -6.07 17.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 109.749 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.742 ' HB3' ' HB3' ' A' ' 4' ' ' LYS . 6.5 t-160 -87.55 32.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.862 178.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -76.55 63.7 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.733 0.778 . . . . 0.0 109.409 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -145.35 54.83 1.2 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -53.61 -39.88 65.28 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.15 -178.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.494 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 60.6 m-20 40.0 90.05 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 124.608 1.192 . . . . 0.0 112.596 170.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.596 HG12 ' HB2' ' A' ' 58' ' ' ALA . 11.7 p -92.32 136.94 23.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.407 -168.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -111.63 104.86 13.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 166.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.818 HG11 HD13 ' A' ' 54' ' ' LEU . 2.5 p -102.83 134.28 44.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 -171.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.528 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HE2' ' HE2' ' A' ' 77' ' ' LYS . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.953 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.688 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.475 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.953 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.688 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.602 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.667 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.818 HD13 HG11 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -61.79 -41.24 97.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.421 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 7.3 tpm_? -85.53 13.04 7.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.238 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.495 HD23 HG21 ' A' ' 12' ' ' VAL . 15.1 tp -106.68 -34.5 7.29 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.596 ' HB2' HG12 ' A' ' 12' ' ' VAL . . . -79.52 174.49 11.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.362 163.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.485 ' CE1' ' HA3' ' A' ' 61' ' ' GLY . 45.9 p-80 -75.32 18.33 0.22 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 177.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 58' ' ' ALA . . . 77.29 41.77 20.47 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 -165.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 63' ' ' VAL . . . -142.55 -125.63 2.02 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.494 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 49.1 tt0 -52.84 108.73 0.34 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.336 0.588 . . . . 0.0 110.896 177.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 50' ' ' VAL . 2.4 p -138.29 103.89 2.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' MET . . . . . 0.528 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.487 ' HG2' ' HG2' ' A' ' 90' ' ' GLN . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.512 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.55 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.783 ' HB2' HD12 ' A' ' 30' ' ' LEU . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.683 HG12 ' HE2' ' A' ' 79' ' ' LYS . 9.8 m -150.16 102.62 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 11.0 ttmt -169.07 -76.48 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 167.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.884 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 15.6 Cg_exo -71.81 8.42 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.311 2.674 . . . . 0.0 113.348 -178.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.683 ' HE2' HG12 ' A' ' 76' ' ' VAL . 35.1 pttt -89.68 31.41 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.94 0.4 . . . . 0.0 111.699 -174.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.99 -55.52 4.54 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 114.294 0.478 . . . . 0.0 114.294 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.24 -63.69 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -174.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -157.43 143.26 17.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -82.72 1.51 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.113 -178.176 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 55.2 36.18 26.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.837 169.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -87.64 115.58 25.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.797 0.332 . . . . 0.0 110.368 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.0 t -141.36 146.36 36.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -107.74 -35.75 2.54 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.639 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -64.8 122.28 16.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -177.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 92' ' ' LEU . . . 93.71 -24.7 24.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.892 -0.67 . . . . 0.0 111.989 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HG2' ' HG2' ' A' ' 68' ' ' GLU . 20.6 tp60 -99.24 -61.96 1.3 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.003 0.43 . . . . 0.0 110.215 -178.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -114.72 47.32 1.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 109.584 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.641 HD23 ' H ' ' A' ' 92' ' ' LEU . 2.3 pt? -82.04 54.72 2.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.206 -174.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 93.38 29.78 9.84 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.427 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 m -78.77 2.49 19.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.032 0.444 . . . . 0.0 111.12 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -145.19 32.53 1.1 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.685 0.755 . . . . 0.0 109.924 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . -145.58 121.39 5.81 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.733 -177.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 21.1 Cg_exo -66.54 -25.58 47.64 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.918 2.412 . . . . 0.0 111.59 176.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -90.17 110.64 21.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.081 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.87 74.99 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.603 0.716 . . . . 0.0 110.715 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 tp -133.82 50.61 2.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.821 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 m 75.33 -57.25 0.6 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.177 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.252 1.202 0 CA-C-O 118.53 -0.748 . . . . 0.0 109.673 174.256 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 m -87.33 98.38 11.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.822 0.344 . . . . 0.0 111.119 -176.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -83.37 -64.83 1.09 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.409 0.623 . . . . 0.0 109.322 173.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 4.6 mmmp? -129.18 -75.64 0.55 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.255 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? 57.69 -172.97 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.361 0.413 . . . . 0.0 110.796 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 57.83 71.68 0.56 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.516 171.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -113.6 90.8 3.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.89 0.852 . . . . 0.0 110.466 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.3 m -130.74 175.42 9.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.709 178.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 m 60.17 32.41 20.88 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 121.461 0.648 . . . . 0.0 110.475 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -84.83 -39.2 18.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.985 -177.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.506 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.6 m-20 65.67 125.49 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.892 0.745 . . . . 0.0 111.613 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.577 ' HB ' ' HB2' ' A' ' 58' ' ' ALA . 7.4 p -91.92 131.61 38.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 112.164 -169.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -103.98 110.85 23.15 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.491 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t -102.96 103.71 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.207 -170.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.853 HG11 ' HG2' ' A' ' 78' ' ' PRO . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.796 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.631 ' HD2' ' HA ' ' A' ' 77' ' ' LYS . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.888 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.486 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.796 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.569 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.408 HD21 HD22 ' A' ' 25' ' ' LEU . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.888 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.486 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.743 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.558 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.51 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.45 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.644 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -73.33 -27.29 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 38.0 mmt180 -78.53 -0.25 28.87 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.089 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -113.02 -59.53 2.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB2' ' HB ' ' A' ' 12' ' ' VAL . . . -98.6 136.36 38.8 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.404 0.621 . . . . 0.0 111.49 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -115.73 85.4 2.28 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.82 176.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -168.64 -40.99 0.03 OUTLIER Glycine 0 CA--C 1.504 -0.655 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 117.31 -15.52 13.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.797 -0.716 . . . . 0.0 113.431 173.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.506 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 47.7 tt0 -80.33 119.21 22.75 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 120.734 0.302 . . . . 0.0 110.345 178.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.465 HG12 ' CG1' ' A' ' 12' ' ' VAL . 12.8 m -127.75 103.33 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 177.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.618 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.62 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.506 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.803 ' HB2' HD12 ' A' ' 30' ' ' LEU . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 10.9 p -153.34 -41.48 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.685 ' HB3' ' CE1' ' A' ' 75' ' ' PHE . 16.5 ptmt 54.85 174.82 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 124.918 1.287 . . . . 0.0 112.126 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.853 ' HG2' HG11 ' A' ' 15' ' ' VAL . 23.2 Cg_exo -68.1 -49.47 0.99 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.908 1.738 . . . . 0.0 111.738 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 59.0 mttm 70.02 -54.32 0.62 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.418 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 158.71 -10.81 0.2 Allowed Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.11 -70.59 0.55 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -146.3 153.94 41.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.915 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.613 ' HE2' ' HZ ' ' A' ' 85' ' ' PHE . 22.0 pttm -92.52 93.9 8.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.074 0.464 . . . . 0.0 110.583 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.74 127.18 22.36 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.916 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.613 ' HZ ' ' HE2' ' A' ' 83' ' ' LYS . 93.3 m-85 -102.31 163.59 12.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.919 -178.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 99.0 m -131.3 117.47 19.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.963 171.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.07 -42.95 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 92' ' ' LEU . 42.3 mt-10 -70.96 -36.68 72.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.998 0.427 . . . . 0.0 110.232 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.69 -11.34 84.57 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.29 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -92.73 -64.59 1.08 Allowed 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.88 -0.188 . . . . 0.0 110.942 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.42 -24.32 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.557 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 5.9 tt 70.65 -61.13 0.48 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.896 0.747 . . . . 0.0 110.939 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.66 130.52 1.56 Allowed Glycine 0 N--CA 1.444 -0.779 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 p -85.48 27.72 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.135 0.493 . . . . 0.0 111.426 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.3 m -68.94 -23.04 64.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.591 0.71 . . . . 0.0 109.532 174.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -128.38 86.83 56.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.152 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.76 -39.54 81.03 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.978 2.452 . . . . 0.0 112.797 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -118.22 132.26 56.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.535 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.99 63.68 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 109.896 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.2 tt -167.48 -57.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.066 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.3 m -69.67 145.75 52.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.911 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.368 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.0 -0.44 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.1 p -86.16 -34.06 20.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.172 0.51 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -75.05 -46.01 37.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.723 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 13.5 ptpt -121.89 98.02 5.76 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.493 174.263 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.0 ptt180 -111.81 164.74 12.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.169 -172.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -148.83 -35.04 0.2 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.893 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -131.09 75.2 1.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 0.0 110.287 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.5 m -145.71 157.38 43.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.234 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t 56.98 43.9 23.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.711 0.767 . . . . 0.0 109.082 -172.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 15.3 mm100 -91.73 46.52 1.29 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.6 -175.273 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -23.34 130.58 0.02 OUTLIER 'General case' 0 C--O 1.237 0.439 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.81 173.348 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.713 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -85.5 117.24 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.733 0.777 . . . . 0.0 109.225 168.376 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -100.4 104.24 15.66 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 54' ' ' LEU . 3.4 t -99.46 102.1 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.239 -164.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.633 HG13 ' HD3' ' A' ' 77' ' ' LYS . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.465 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.934 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.642 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.804 ' HB2' HD21 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.435 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.465 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.567 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.461 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.537 HG11 HG21 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -61.43 -57.41 12.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -81.4 47.44 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.765 0.793 . . . . 0.0 109.684 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 54' ' ' LEU . 39.1 tp -129.63 -51.75 1.16 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.186 168.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.713 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -57.98 137.82 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.18 172.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 10' ' ' GLN . 23.9 m-70 -98.16 78.44 2.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.657 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 165.72 -33.61 0.24 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.108 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.95 -15.09 55.72 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.854 -0.689 . . . . 0.0 113.4 174.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.538 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 40.4 tt0 -71.88 125.94 28.46 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.537 HG21 HG11 ' A' ' 50' ' ' VAL . 41.6 t -131.26 106.83 12.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -176.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.637 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.708 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PHE . . . . . 0.608 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p -171.59 110.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.721 ' HB3' ' CD ' ' A' ' 78' ' ' PRO . 22.2 ttmt -161.46 -86.21 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 118.655 -0.688 . . . . 0.0 112.615 175.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.721 ' CD ' ' HB3' ' A' ' 77' ' ' LYS . 38.3 Cg_endo -64.36 -16.51 55.5 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 122.472 2.115 . . . . 0.0 111.82 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -66.83 -44.36 81.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.088 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.47 70.14 0.87 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.746 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.46 -79.52 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.47 0.708 . . . . 0.0 112.235 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 72.6 m-85 -136.66 -84.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -174.422 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -94.56 -9.39 35.36 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.109 -0.237 . . . . 0.0 111.476 -174.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.12 -168.72 0.17 Allowed 'General case' 0 C--O 1.237 0.421 0 O-C-N 123.82 0.7 . . . . 0.0 111.362 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -166.44 140.05 4.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.981 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -76.96 -24.82 52.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.071 0.462 . . . . 0.0 110.603 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.24 -69.73 3.08 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.658 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.85 -37.83 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.401 0.62 . . . . 0.0 110.794 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 114.45 143.44 8.27 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.642 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -104.21 -15.32 15.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.367 0.603 . . . . 0.0 109.797 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -85.06 -50.86 7.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.397 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.8 tp 48.14 52.61 12.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.138 0.971 . . . . 0.0 110.461 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 94' ' ' SER . . . 169.82 89.44 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 93' ' ' GLY . 69.1 m 73.86 125.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -163.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' A' ' 96' ' ' ALA . 10.5 m -50.98 -42.35 60.14 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -166.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.42 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . 73.12 126.19 0.03 OUTLIER Pre-proline 0 C--O 1.235 0.293 0 O-C-N 123.919 0.762 . . . . 0.0 110.498 -174.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 16.8 Cg_exo -65.68 159.77 46.7 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.704 2.269 . . . . 0.0 111.841 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -72.72 -97.51 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.745 -178.523 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 18.7 t 43.89 -96.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.162 0.585 . . . . 0.0 111.338 -177.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' VAL . 13.5 tp 175.47 -60.5 0.01 OUTLIER 'General case' 0 C--O 1.231 0.109 0 C-N-CA 123.125 0.57 . . . . 0.0 110.196 176.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.2 m -87.66 39.08 0.86 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.225 -172.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.818 -177.09 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.9 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.714 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.492 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.658 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.9 ' HB2' HD21 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.443 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.784 HD13 HD21 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.74 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.424 HD21 HD12 ' A' ' 25' ' ' LEU . 1.1 p-10 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.829 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.655 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.662 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.719 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.4 HG21 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.524 HG21 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.555 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.784 HD21 HD13 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.524 HH11 HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.42 HG21 ' HD2' ' A' ' 55' ' ' ARG . 46.0 t . . . . . 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.587 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.829 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.538 HG21 HD22 ' A' ' 54' ' ' LEU . 15.3 m . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.958 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.467 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.787 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.958 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.538 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.537 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.518 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 p30 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.787 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.611 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.575 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.664 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.664 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.745 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.578 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.745 ' HB3' HE22 ' A' ' 40' ' ' GLN . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.538 HD22 HG21 ' A' ' 14' ' ' VAL . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 3.6 p . . . . . 0 N--CA 1.445 -0.687 0 CA-C-O 121.307 0.575 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.709 HD11 HD12 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.494 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.483 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.741 ' HB2' HD12 ' A' ' 30' ' ' LEU . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.514 HG12 ' HH2' ' A' ' 19' ' ' TRP . 8.9 p . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t . . . . . 0 N--CA 1.449 -0.513 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.713 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.794 HD12 HD21 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB3' ' CZ2' ' A' ' 19' ' ' TRP . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.939 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.663 ' CZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 1.036 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.476 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.63 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.452 HE22 ' CG ' ' A' ' 53' ' ' GLU . 12.2 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.663 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.672 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.43 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.543 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.652 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.589 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.543 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 . . . . . 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 50' ' ' VAL . 5.5 m . . . . . 0 N--CA 1.444 -0.727 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.794 HD21 HD12 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.438 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.616 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.638 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.682 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 1.036 ' HB2' HD12 ' A' ' 30' ' ' LEU . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t . . . . . 0 N--CA 1.443 -0.802 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.558 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.864 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.795 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.472 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.622 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.558 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.558 HD21 HD22 ' A' ' 25' ' ' LEU . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.526 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.494 ' CE1' ' HD1' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.68 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.747 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.677 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.747 ' HB3' HE22 ' A' ' 40' ' ' GLN . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.508 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.594 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.447 -0.622 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.806 HD11 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.634 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.929 HG21 HD22 ' A' ' 54' ' ' LEU . 77.4 t . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.843 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.843 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 71' ' ' ARG . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.514 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.751 ' HB2' HD21 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.649 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.625 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.781 ' HB2' HG13 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.442 ' OD1' HD21 ' A' ' 54' ' ' LEU . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.921 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.522 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.742 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.742 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.749 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.724 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.61 HD13 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.492 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.749 ' HB3' HE22 ' A' ' 40' ' ' GLN . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.724 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.929 HD22 HG21 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.416 HG21 ' HB2' ' A' ' 54' ' ' LEU . 2.6 p . . . . . 0 N--CA 1.446 -0.66 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 64' ' ' ASN . 2.4 t-20 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.501 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.895 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 76' ' ' VAL . 7.5 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 54' ' ' LEU . 40.6 t . . . . . 0 N--CA 1.447 -0.607 0 N-CA-C 109.419 -0.585 . . . . 0.0 109.419 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.523 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.443 HD21 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.78 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.491 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.548 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.504 HD21 ' CD1' ' A' ' 25' ' ' LEU . 11.4 p30 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.56 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.78 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.507 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.806 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.806 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.694 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.761 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.43 HD11 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.727 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.727 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.463 HG11 HG13 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.694 ' HB3' HE22 ' A' ' 40' ' ' GLN . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.761 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? . . . . . 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.463 HG13 HG11 ' A' ' 50' ' ' VAL . 2.6 p . . . . . 0 N--CA 1.437 -1.117 0 CA-C-O 121.712 0.768 . . . . 0.0 108.974 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.519 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.519 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.583 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 74' ' ' ASP . 4.9 t . . . . . 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.563 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.689 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.918 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.404 ' N ' HD23 ' A' ' 16' ' ' LEU . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.831 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.918 ' HB2' HD21 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.521 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.831 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.647 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.667 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.667 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.659 HD21 HD12 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.559 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.461 HG11 ' HA ' ' A' ' 55' ' ' ARG . 5.2 m . . . . . 0 N--CA 1.443 -0.823 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.855 HD11 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.473 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.41 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.639 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.737 ' HB2' HD12 ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.404 ' HA ' ' HB2' ' A' ' 26' ' ' ASP . 32.0 t . . . . . 0 N--CA 1.444 -0.733 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.882 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.587 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.882 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.556 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.64 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.403 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.777 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.587 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.683 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.777 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.725 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.817 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.725 ' HB3' HE22 ' A' ' 40' ' ' GLN . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.817 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.442 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.9 OUTLIER . . . . . 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 7.4 p . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.892 ' HB2' HD12 ' A' ' 30' ' ' LEU . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 76' ' ' VAL . 7.2 p . . . . . 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 54' ' ' LEU . 36.0 t . . . . . 0 CA--C 1.507 -0.71 0 CA-C-O 121.098 0.475 . . . . 0.0 110.779 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HE2' ' OE1' ' A' ' 68' ' ' GLU . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.742 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.43 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.727 ' HB2' HD21 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.742 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.473 HD22 HD21 ' A' ' 27' ' ' ASN . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.473 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.572 HD13 ' HD1' ' A' ' 19' ' ' TRP . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.445 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.79 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.79 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.598 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.579 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.579 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.716 HG13 HD12 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.716 HD12 HG13 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 6.5 m . . . . . 0 N--CA 1.451 -0.378 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.489 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.675 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.52 ' HB2' HD22 ' A' ' 30' ' ' LEU . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' HG13 ' A' ' 76' ' ' VAL . 5.6 p . . . . . 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 26' ' ' ASP . 1.9 m . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.728 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.876 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.618 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.595 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.553 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.647 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.572 ' HB3' HG12 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.647 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.595 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.54 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.595 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.853 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.716 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.608 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.853 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.608 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 tmt_? . . . . . 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 38.2 t . . . . . 0 C--O 1.236 0.382 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.488 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.526 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.696 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.415 ' O ' HG13 ' A' ' 76' ' ' VAL . 7.0 p . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.802 HG11 HD22 ' A' ' 54' ' ' LEU . 13.1 m . . . . . 0 N--CA 1.441 -0.894 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.776 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.847 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.504 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.776 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.45 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.717 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.472 ' OD1' HD12 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.866 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.556 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 34' ' ' GLN . 15.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.486 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.646 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.737 HG23 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.646 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.802 HD22 HG11 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 55' ' ' ARG . 1.4 tpp180 . . . . . 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.737 HG11 HG23 ' A' ' 50' ' ' VAL . 54.5 t . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.785 0.326 . . . . 0.0 111.518 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.437 HD11 HD12 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.679 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.866 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.814 HG11 HD22 ' A' ' 54' ' ' LEU . 98.8 t . . . . . 0 N--CA 1.45 -0.445 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.861 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.861 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.488 HD21 ' HD2' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.736 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.68 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.577 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.544 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.512 HD21 HD12 ' A' ' 25' ' ' LEU . 9.6 p30 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.736 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.68 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.671 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.671 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.513 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.652 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.541 HG11 HG13 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.513 ' HB3' HE22 ' A' ' 40' ' ' GLN . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.652 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.814 HD22 HG11 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 . . . . . 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.541 HG13 HG11 ' A' ' 50' ' ' VAL . 7.4 p . . . . . 0 N--CA 1.446 -0.653 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.494 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HD2' HD21 ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.665 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.632 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.522 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.867 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.495 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.661 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.542 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.454 ' HB3' HG12 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.416 ' HD3' ' HB3' ' A' ' 38' ' ' ASN . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.661 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.834 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.834 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.748 HG11 HH21 ' A' ' 55' ' ' ARG . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.54 ' HD2' HD11 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.689 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.54 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.748 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 . . . . . 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.746 HG11 HG21 ' A' ' 50' ' ' VAL . 3.6 p . . . . . 0 N--CA 1.443 -0.793 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.457 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.535 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.933 HG13 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.629 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.933 ' HE3' HG13 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.959 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.629 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.6 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 15' ' ' VAL . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.959 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.663 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.605 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.787 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.787 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.524 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.695 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.532 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.627 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 121.509 0.671 . . . . 0.0 109.273 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.559 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.596 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.466 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.466 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.859 ' HB2' HD12 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t . . . . . 0 N--CA 1.445 -0.722 0 CA-C-O 121.118 0.485 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.408 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.56 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.837 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.535 ' HB2' HD21 ' A' ' 16' ' ' LEU . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.688 HD22 HD21 ' A' ' 27' ' ' ASN . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.688 HD21 HD22 ' A' ' 25' ' ' LEU . 7.9 p30 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.528 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.404 ' HD1' HD11 ' A' ' 42' ' ' LEU . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.68 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD11 ' HD1' ' A' ' 33' ' ' TYR . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 43' ' ' GLU . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.486 ' HD2' HD11 ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.486 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB2' HD12 ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.73 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.61 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.873 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.535 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.568 HD22 HD12 ' A' ' 25' ' ' LEU . 2.1 m-80 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.726 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.669 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.726 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.545 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.741 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.741 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.535 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.637 ' HD2' HD12 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.73 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.728 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 13.8 t . . . . . 0 N--CA 1.445 -0.678 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.61 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.572 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.579 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.572 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.53 HG21 HD22 ' A' ' 54' ' ' LEU . 33.1 t . . . . . 0 N--CA 1.456 -0.16 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.52 ' HG2' ' HB2' ' A' ' 68' ' ' GLU . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.954 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.59 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.99 ' HB2' HD21 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.714 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.666 ' H ' HD12 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.615 HD21 HD13 ' A' ' 25' ' ' LEU . 7.8 p30 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.954 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.633 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.524 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.679 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.679 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.539 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 42' ' ' LEU . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.457 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.627 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.539 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.433 HD22 ' HA ' ' A' ' 64' ' ' ASN . 1.7 t-20 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.601 ' HG3' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.756 ' HB2' HD12 ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 76' ' ' VAL . 9.2 p . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.818 HG11 HD13 ' A' ' 54' ' ' LEU . 2.5 p . . . . . 0 N--CA 1.449 -0.483 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.528 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.953 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.688 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.475 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.509 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.953 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.688 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.602 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.667 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.667 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.818 HD13 HG11 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 50' ' ' VAL . 2.4 p . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 121.098 0.475 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 64' ' ' ASN . 2.0 t-20 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . 0.528 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.512 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.55 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.783 ' HB2' HD12 ' A' ' 30' ' ' LEU . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 76' ' ' VAL . 9.8 m . . . . . 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.491 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t . . . . . 0 N--CA 1.445 -0.685 0 CA-C-O 121.356 0.598 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.796 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.888 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.486 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.796 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.569 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.408 HD21 HD22 ' A' ' 25' ' ' LEU . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.888 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.486 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.743 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.558 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.51 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.45 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 12.8 m . . . . . 0 N--CA 1.451 -0.381 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.618 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.62 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.506 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.803 ' HB2' HD12 ' A' ' 30' ' ' LEU . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 10.9 p . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 54' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.432 -1.369 0 CA-C-O 121.696 0.76 . . . . 0.0 109.239 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.465 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.934 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.642 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.804 ' HB2' HD21 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.435 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ARG . . . . . 0.642 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.465 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.567 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.461 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.537 HG11 HG21 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 . . . . . 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.537 HG21 HG11 ' A' ' 50' ' ' VAL . 41.6 t . . . . . 0 C--O 1.234 0.237 0 CA-C-O 120.78 0.324 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.637 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.708 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PHE . . . . . 0.608 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.4 m -78.87 -40.13 33.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -176.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 14.7 tp10 67.95 -75.38 0.06 Allowed 'General case' 0 N--CA 1.464 0.248 0 O-C-N 123.652 0.595 . . . . 0.0 111.427 178.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.453 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -154.4 79.12 1.1 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.45 0.643 . . . . 0.0 110.328 -178.927 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 60.8 mtm180 -137.79 -74.62 0.4 Allowed 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -173.57 158.98 3.51 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.841 176.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -87.84 94.03 9.64 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 m -39.06 109.14 0.1 Allowed 'General case' 0 C--O 1.235 0.326 0 O-C-N 124.489 1.118 . . . . 0.0 112.877 -173.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.7 t -80.84 72.4 7.83 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.442 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -117.88 23.45 11.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.052 178.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.465 ' HB3' ' NE2' ' A' ' 62' ' ' GLN . 10.4 m-20 56.39 88.42 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.871 177.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.474 ' CG2' ' HB2' ' A' ' 58' ' ' ALA . 14.5 m -119.2 167.18 12.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 121.527 0.68 . . . . 0.0 112.118 -167.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -104.18 132.54 50.32 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.117 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 18.7 m -103.42 111.97 35.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 171.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.74 HG12 ' HB2' ' A' ' 26' ' ' ASP . 10.8 p -78.54 129.6 37.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-O 121.605 0.717 . . . . 0.0 111.549 -173.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.9 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -108.16 116.58 32.23 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 172.579 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.507 ' HD2' ' HB2' ' A' ' 77' ' ' LYS . 65.4 mttm -103.94 139.92 38.42 Favored 'General case' 0 C--N 1.313 -1.001 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.069 179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.11 125.58 46.24 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.257 -0.883 . . . . 0.0 108.779 -178.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.714 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 29.6 m95 -118.72 -174.66 2.73 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.308 -175.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.492 ' HB2' ' NZ ' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -81.55 -23.81 36.95 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.822 0.344 . . . . 0.0 111.123 178.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 51.3 m -99.95 -44.64 5.96 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.708 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.658 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.22 -139.62 2.68 Favored Glycine 0 N--CA 1.444 -0.797 0 C-N-CA 119.985 -1.102 . . . . 0.0 113.55 -176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.9 ' HB2' HD21 ' A' ' 16' ' ' LEU . 40.0 p90 -141.76 149.66 40.74 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.476 -0.362 . . . . 0.0 110.037 -175.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.443 ' HG ' ' HZ2' ' A' ' 19' ' ' TRP . 93.9 p -131.09 147.05 52.57 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 120.73 0.3 . . . . 0.0 110.881 178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.784 HD13 HD21 ' A' ' 54' ' ' LEU . 1.6 mt -109.18 159.3 17.03 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.74 ' HB2' HG12 ' A' ' 15' ' ' VAL . 34.2 t70 -62.83 -12.17 22.89 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 121.37 0.605 . . . . 0.0 111.459 -176.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.424 HD21 HD12 ' A' ' 25' ' ' LEU . 1.1 p-10 -93.93 -25.56 17.23 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.985 179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.64 -159.99 8.75 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.237 -0.983 . . . . 0.0 113.069 -172.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.463 ' HA ' ' HZ ' ' A' ' 75' ' ' PHE . 41.5 mt-10 -110.44 -171.89 1.92 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.846 0.355 . . . . 0.0 111.21 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.829 ' HB2' ' CD1' ' A' ' 75' ' ' PHE . 3.9 tt -75.11 125.74 29.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.349 0.595 . . . . 0.0 110.087 -175.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.655 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 64.7 mtt85 -116.8 122.39 44.28 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.532 175.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.658 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.3 m -69.83 150.98 46.25 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.925 0.393 . . . . 0.0 111.791 -172.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -74.82 44.75 0.23 Allowed 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.836 -174.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 -140.38 -43.1 0.41 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.953 0.406 . . . . 0.0 111.138 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.662 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.4 t70 -59.54 135.25 89.04 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.077 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 18.4 Cg_exo -67.87 -13.78 39.47 Favored 'Trans proline' 0 CA--C 1.532 0.421 0 C-N-CA 123.341 2.694 . . . . 0.0 113.797 -178.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.1 m -87.84 -26.68 22.68 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.276 0.56 . . . . 0.0 109.853 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.662 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.2 m-20 -78.66 -18.33 54.6 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.611 176.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.16 -39.19 63.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.825 -1.08 . . . . 0.0 112.368 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.52 -60.82 2.9 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.69 0.281 . . . . 0.0 111.227 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -45.69 -59.77 2.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.514 173.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.719 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 31.9 mt -51.32 -44.56 61.98 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.684 -178.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -71.61 -48.53 47.46 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.164 0.506 . . . . 0.0 111.165 -176.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 14.3 m -67.14 -45.16 77.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.4 HG21 HD12 ' A' ' 16' ' ' LEU . 72.4 mt -71.5 -27.18 27.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.859 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.719 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 13.1 ttt180 -55.9 -54.63 42.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.494 -0.776 . . . . 0.0 109.2 171.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 -63.5 -58.36 7.27 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.878 -1.055 . . . . 0.0 111.779 176.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 135.66 -2.35 3.73 Favored Glycine 0 N--CA 1.445 -0.727 0 N-CA-C 110.175 -1.17 . . . . 0.0 110.175 -172.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -72.31 164.38 26.39 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.295 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.524 HG21 HH11 ' A' ' 55' ' ' ARG . 13.9 p -105.43 116.68 59.83 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 121.361 0.601 . . . . 0.0 112.607 -171.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.555 ' HD2' ' CD1' ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.77 143.84 99.45 Favored 'Trans proline' 0 C--O 1.237 0.442 0 C-N-CA 122.347 2.031 . . . . 0.0 111.413 168.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.58 -33.26 71.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.089 -0.96 . . . . 0.0 112.357 -173.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -59.25 -27.36 65.71 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -177.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.784 HD21 HD13 ' A' ' 25' ' ' LEU . 7.2 mt -80.68 -42.05 22.67 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.023 0.439 . . . . 0.0 110.024 -177.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.524 HH11 HG21 ' A' ' 50' ' ' VAL . 0.2 OUTLIER -74.51 -21.12 59.71 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.811 177.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 37.6 mmt180 -87.32 9.68 19.66 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.86 170.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -113.17 -58.83 2.1 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.965 ' HB3' HG22 ' A' ' 63' ' ' VAL . . . -90.41 160.03 16.27 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 171.232 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.406 ' C ' ' H ' ' A' ' 61' ' ' GLY . 0.2 OUTLIER -59.78 160.68 7.2 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 107.545 -1.28 . . . . 0.0 107.545 169.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -71.34 33.13 0.55 Allowed Glycine 0 CA--C 1.521 0.421 0 C-N-CA 120.906 -0.664 . . . . 0.0 114.399 -170.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' A' ' 59' ' ' HIS . . . -102.08 -131.09 7.23 Favored Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.39 -0.684 . . . . 0.0 111.39 176.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.465 ' NE2' ' HB3' ' A' ' 11' ' ' ASP . 28.0 tt0 -66.59 87.0 0.12 Allowed 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.393 0.616 . . . . 0.0 111.29 175.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.965 HG22 ' HB3' ' A' ' 58' ' ' ALA . 46.0 t -97.1 101.45 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.111 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 165.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -108.22 137.34 46.36 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -176.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.485 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 8.9 tt -103.94 116.91 33.11 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.418 0.628 . . . . 0.0 110.441 -176.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -104.24 127.99 51.94 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.31 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.454 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 44.0 mtt -97.25 137.56 36.07 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.252 0.548 . . . . 0.0 112.378 -174.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -124.17 155.29 38.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.228 -0.896 . . . . 0.0 109.789 172.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -114.26 133.53 55.57 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 174.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 50.7 m-70 -138.36 -44.22 0.5 Allowed 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 176.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.587 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.0 mtm180 57.44 -94.34 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 114.666 -1.152 . . . . 0.0 113.47 171.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -73.44 10.03 1.16 Allowed 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.136 0.493 . . . . 0.0 111.72 -175.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.588 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 59.5 mm-40 -83.89 4.49 29.21 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.967 173.468 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 61.45 -100.6 0.1 Allowed 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.16 -175.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.829 ' CD1' ' HB2' ' A' ' 30' ' ' LEU . 29.9 t80 -146.72 120.56 9.29 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 177.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -148.33 97.94 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.35 173.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.674 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -138.77 -65.06 0.02 OUTLIER Pre-proline 0 CA--C 1.546 0.804 0 O-C-N 122.215 -0.303 . . . . 0.0 111.393 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.674 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 23.5 Cg_exo -71.62 -32.22 12.27 Favored 'Trans proline' 0 N--CA 1.475 0.414 0 C-N-CA 123.862 3.041 . . . . 0.0 111.851 174.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt -36.41 -48.84 0.68 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 113.687 -1.597 . . . . 0.0 113.605 -177.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 163.0 172.92 31.09 Favored Glycine 0 N--CA 1.446 -0.671 0 C-N-CA 120.332 -0.937 . . . . 0.0 111.8 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 62.04 -169.64 0.17 Allowed 'General case' 0 C--O 1.232 0.144 0 O-C-N 124.062 0.507 . . . . 0.0 110.62 -179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.429 ' C ' ' H ' ' A' ' 84' ' ' ALA . 85.9 m-85 -128.15 136.68 51.46 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 178.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' C ' ' HZ1' ' A' ' 17' ' ' LYS . 16.6 mtmt 64.9 -7.59 0.26 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.74 0.816 . . . . 0.0 112.748 -175.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.429 ' H ' ' C ' ' A' ' 82' ' ' PHE . . . 61.42 35.17 17.87 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.076 0.55 . . . . 0.0 110.984 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.575 ' HB2' ' HA ' ' A' ' 91' ' ' LYS . 96.3 m-85 66.04 72.41 0.4 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.35 -0.841 . . . . 0.0 112.459 175.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.411 ' OG1' ' HB3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -97.92 12.79 32.95 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.495 173.253 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -90.18 103.32 3.01 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.803 -175.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 52.35 79.15 0.11 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.516 0.674 . . . . 0.0 110.845 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 118.72 -157.23 15.34 Favored Glycine 0 N--CA 1.444 -0.823 0 N-CA-C 110.964 -0.854 . . . . 0.0 110.964 -175.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.47 ' HG3' ' HG3' ' A' ' 73' ' ' GLU . 2.8 tp-100 -150.08 109.87 4.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 117.152 0.476 . . . . 0.0 110.713 -179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 85' ' ' PHE . 5.7 ttpm? 72.96 -40.07 0.46 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.825 0.85 . . . . 0.0 111.656 178.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 89.2 mt 54.19 59.65 4.08 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 122.783 0.433 . . . . 0.0 111.824 173.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 86.62 -30.81 4.42 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 121.044 -0.598 . . . . 0.0 113.657 173.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.531 ' HB3' ' CG ' ' A' ' 91' ' ' LYS . 38.0 p 46.61 51.07 12.43 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.215 0.531 . . . . 0.0 111.383 -176.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.1 p -80.83 57.84 3.16 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.22 0.533 . . . . 0.0 111.377 -178.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -116.75 90.79 32.91 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.975 177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -68.45 -9.21 25.32 Favored 'Trans proline' 0 C--N 1.343 0.26 0 C-N-CA 122.57 2.18 . . . . 0.0 112.381 178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.92 166.5 17.39 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.766 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 43.8 t -95.54 -36.55 6.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.081 0.467 . . . . 0.0 110.806 -175.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 52.0 mt -105.34 160.85 14.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.736 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.9 m 69.31 14.9 8.54 Favored 'General case' 0 N--CA 1.467 0.39 0 O-C-N 123.501 0.501 . . . . 0.0 111.817 177.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.3 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.819 176.499 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.944 0 N-CA-C 112.132 -0.387 . . . . 0.0 112.132 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -79.97 87.58 5.38 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 175.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.429 ' OE2' ' HD2' ' A' ' 5' ' ' ARG . 10.3 pt-20 -137.48 176.81 8.38 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.189 0.518 . . . . 0.0 111.459 -169.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.465 ' HD2' ' N ' ' A' ' 4' ' ' LYS . 11.0 mptt -95.33 -7.82 37.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.338 -0.847 . . . . 0.0 109.328 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.445 ' HB3' ' H ' ' A' ' 6' ' ' GLN . 7.3 tpt180 68.72 -86.88 0.03 OUTLIER 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.914 177.32 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.445 ' H ' ' HB3' ' A' ' 5' ' ' ARG . 94.3 mt-30 52.95 -103.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 122.955 0.502 . . . . 0.0 111.722 -179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 52.0 m170 66.38 -77.27 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 122.984 0.513 . . . . 0.0 111.211 -175.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.505 ' HB3' ' O ' ' A' ' 11' ' ' ASP . 27.8 m -97.43 113.13 24.75 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 120.969 0.414 . . . . 0.0 110.14 -178.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.2 p -101.58 -49.02 4.14 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.032 0.444 . . . . 0.0 110.74 -179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -83.74 -48.31 10.25 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.468 -178.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.537 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 6.6 p-10 -145.6 144.55 30.53 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.701 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.82 ' HB ' ' HB2' ' A' ' 58' ' ' ALA . 2.5 p -111.98 119.04 59.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.109 168.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -112.02 104.34 12.59 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.746 176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.538 HG21 HD22 ' A' ' 54' ' ' LEU . 15.3 m -104.55 127.87 58.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.212 0.529 . . . . 0.0 110.877 -178.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.599 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -86.45 127.9 39.94 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.655 176.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.958 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.3 tt -110.49 118.22 35.68 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.683 ' CE ' ' HA ' ' A' ' 78' ' ' PRO . 60.2 mttm -103.7 135.63 44.91 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 175.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.467 HD22 HD22 ' A' ' 16' ' ' LEU . 4.4 mm? -99.86 136.44 39.77 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 -179.24 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.787 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 30.1 m95 -128.15 -176.76 3.9 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.015 0.436 . . . . 0.0 111.053 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.411 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -74.25 -26.79 60.43 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.243 178.635 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 30.8 m -95.26 -46.59 6.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.856 0.36 . . . . 0.0 110.956 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.575 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -162.76 -136.39 1.98 Allowed Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.225 -176.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.958 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.5 p90 -144.98 146.09 31.8 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 -174.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.538 ' HB3' ' HA ' ' A' ' 30' ' ' LEU . 64.3 p -127.99 149.3 50.41 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.541 0.21 . . . . 0.0 110.693 178.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 0.7 OUTLIER -127.13 -179.89 5.09 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.051 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.537 ' HB3' HG12 ' A' ' 14' ' ' VAL . 38.8 t70 -70.89 -27.51 63.86 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.216 0.531 . . . . 0.0 110.411 177.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.518 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 p30 -81.87 -25.35 35.13 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.111 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -159.46 147.82 15.69 Favored Glycine 0 C--O 1.226 -0.388 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.018 -175.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -77.76 -167.08 0.89 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -172.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.787 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.5 tt -59.32 119.2 6.98 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.866 0.841 . . . . 0.0 111.275 -170.566 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.611 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 56.1 mtt180 -117.5 114.59 23.69 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.528 -1.215 . . . . 0.0 110.075 177.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.575 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 28.1 t -58.41 143.58 44.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.072 0.463 . . . . 0.0 111.111 178.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -66.12 -13.36 59.97 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.055 -172.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -82.62 -27.78 31.21 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 112.1 0.407 . . . . 0.0 112.1 -171.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.664 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.4 t70 -70.62 132.53 87.23 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-O 120.977 0.418 . . . . 0.0 111.627 -178.351 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.1 Cg_exo -67.27 -11.5 32.44 Favored 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 123.528 2.819 . . . . 0.0 114.753 -175.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 23.1 t -89.24 -28.68 19.77 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.664 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -78.98 -24.68 43.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 114.374 -1.284 . . . . 0.0 109.447 177.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.36 -26.16 62.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.328 -0.851 . . . . 0.0 110.922 175.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.745 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -57.24 -49.91 74.56 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.023 174.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.491 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 98.6 m-85 -62.83 -53.06 59.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.689 178.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.578 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 83.3 mt -52.71 -40.15 62.7 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.646 -0.707 . . . . 0.0 111.601 -177.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.429 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 13.7 tp10 -70.31 -52.6 21.57 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.798 0.332 . . . . 0.0 110.924 -178.263 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 49.9 m -60.6 -45.78 92.72 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.662 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.5 mt -70.78 -29.18 36.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 121.344 0.592 . . . . 0.0 110.223 -176.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 71.0 ttt180 -60.81 -47.67 85.31 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.305 -0.862 . . . . 0.0 110.31 174.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 30.4 mmm180 -74.63 -30.31 61.6 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.867 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.93 6.22 37.52 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.27 -0.732 . . . . 0.0 111.27 -176.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -84.4 169.57 14.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.009 0.433 . . . . 0.0 110.206 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.6 p -88.88 120.39 70.03 Favored Pre-proline 0 C--N 1.319 -0.756 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.936 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.745 ' HB3' HE22 ' A' ' 40' ' ' GLN . 50.2 Cg_exo -58.72 131.88 44.78 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.39 2.06 . . . . 0.0 111.318 170.069 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.412 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.5 -29.72 68.05 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.991 -174.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.491 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -63.2 -24.72 68.01 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.624 0.25 . . . . 0.0 111.587 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.538 HD22 HG21 ' A' ' 14' ' ' VAL . 1.8 mt -87.17 -40.6 14.45 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-O 121.896 0.855 . . . . 0.0 108.703 -179.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.414 ' NH2' ' H ' ' A' ' 61' ' ' GLY . 0.0 OUTLIER -66.14 -44.23 84.79 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.357 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.412 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 25.3 mmt180 -83.03 44.9 0.97 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.285 0.564 . . . . 0.0 109.933 178.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -137.03 -58.14 0.71 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 174.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.82 ' HB2' ' HB ' ' A' ' 12' ' ' VAL . . . -75.7 141.33 42.71 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.942 170.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -45.66 -49.46 14.39 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.691 0.619 . . . . 0.0 112.283 -173.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 160.46 71.67 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.607 0 C-N-CA 119.84 -1.172 . . . . 0.0 113.628 173.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.414 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . -156.43 -127.73 1.03 Allowed Glycine 0 N--CA 1.438 -1.181 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.858 168.066 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.537 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 31.7 tt0 -52.04 116.42 2.18 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.33 0.586 . . . . 0.0 111.155 -176.543 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.584 HG23 HG13 ' A' ' 12' ' ' VAL . 3.6 p -133.92 104.51 6.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.17 -177.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -128.43 162.95 25.95 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-O 121.275 0.56 . . . . 0.0 111.179 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.709 HD11 HD12 ' A' ' 16' ' ' LEU . 6.2 tt -135.51 132.05 36.81 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.949 -175.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -103.79 165.42 11.05 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.493 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 97.9 mtp -139.16 143.95 38.39 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.667 0.746 . . . . 0.0 112.915 -173.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -132.22 152.66 51.21 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.083 175.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -122.45 103.97 9.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-O 121.039 0.447 . . . . 0.0 110.766 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.609 ' HE1' HG23 ' A' ' 86' ' ' THR . 56.4 m-70 -132.14 45.18 2.8 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.316 0.579 . . . . 0.0 109.668 -179.565 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.483 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 77.1 mtp180 -84.12 62.94 7.39 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.588 -171.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.1 t70 177.32 -29.49 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 113.973 -1.467 . . . . 0.0 108.631 -173.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.494 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 10.2 mt-10 -84.49 -15.88 44.43 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.451 -1.249 . . . . 0.0 113.432 -173.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.95 164.22 0.17 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.429 0.455 . . . . 0.0 110.986 -174.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.776 ' CZ ' ' HD3' ' A' ' 78' ' ' PRO . 33.8 t80 -58.64 113.94 2.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.631 -171.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.514 HG12 ' HH2' ' A' ' 19' ' ' TRP . 8.9 p -106.08 6.45 10.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.029 171.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.742 ' HA ' ' CZ ' ' A' ' 75' ' ' PHE . 4.2 mtpt 80.9 144.84 0.09 OUTLIER Pre-proline 0 N--CA 1.47 0.54 0 CA-C-N 114.266 -1.334 . . . . 0.0 112.053 177.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.776 ' HD3' ' CZ ' ' A' ' 75' ' ' PHE . 17.2 Cg_exo -68.86 -76.69 0.01 OUTLIER 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 122.641 2.227 . . . . 0.0 110.643 179.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.814 ' HE2' ' HA ' ' A' ' 79' ' ' LYS . 9.6 mmpt? 66.02 -76.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.401 0 O-C-N 123.858 0.724 . . . . 0.0 111.417 170.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 107.94 94.65 2.36 Favored Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.36 177.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.587 ' H ' ' HB2' ' A' ' 85' ' ' PHE . . . 72.71 -34.75 0.31 Allowed 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.726 0.81 . . . . 0.0 112.557 176.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -52.26 -39.9 60.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.14 0.495 . . . . 0.0 110.397 175.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -157.45 130.87 7.86 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.607 174.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 59.84 51.85 5.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.522 168.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.587 ' HB2' ' H ' ' A' ' 81' ' ' ALA . 42.3 t80 -90.33 59.24 4.31 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 172.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.609 HG23 ' HE1' ' A' ' 70' ' ' HIS . 2.8 t -114.45 74.49 0.88 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.029 -172.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.88 -46.31 5.71 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.608 -0.806 . . . . 0.0 111.219 176.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -87.63 89.06 7.85 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 177.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 139.24 72.32 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.473 -0.651 . . . . 0.0 111.473 -176.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -100.6 167.95 10.01 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.941 0.4 . . . . 0.0 110.896 -178.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -73.44 104.71 4.52 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.063 -178.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -89.5 63.7 6.43 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -142.04 164.49 26.82 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.79 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 47.5 m 59.21 51.52 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.334 0.588 . . . . 0.0 109.933 -176.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 14.7 p -76.51 77.18 3.22 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.454 -175.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -127.54 99.5 26.86 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.94 177.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -55.64 -51.58 9.51 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.049 2.499 . . . . 0.0 111.656 178.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 62.4 mm-40 59.4 178.87 0.08 Allowed 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.85 0.833 . . . . 0.0 113.085 174.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.9 p -89.57 -28.02 5.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.962 176.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 24.7 mt -147.6 135.82 21.48 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.062 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 57.2 m 62.38 -161.34 0.3 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 123.728 0.642 . . . . 0.0 111.814 173.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--O 1.252 1.193 0 CA-C-O 118.285 -0.864 . . . . 0.0 109.454 -177.614 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.9 t 65.13 -173.83 0.18 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.008 0.523 . . . . 0.0 110.825 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -138.06 148.39 45.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.443 -177.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.441 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 32.9 ttpt 59.31 53.12 5.48 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 121.436 0.636 . . . . 0.0 110.664 176.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 10.0 mmm180 -130.35 177.87 7.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.855 177.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' ' CZ ' ' A' ' 5' ' ' ARG . 15.0 mm100 65.6 174.38 0.22 Allowed 'General case' 0 N--CA 1.463 0.207 0 O-C-N 123.872 0.732 . . . . 0.0 110.931 -177.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.442 ' HB2' ' OE1' ' A' ' 10' ' ' GLN . 28.1 m80 -63.68 -62.19 1.82 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.008 0.432 . . . . 0.0 110.076 176.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t 69.93 -50.76 0.64 Allowed 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.593 -176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.628 ' HA ' ' HB2' ' A' ' 59' ' ' HIS . 19.8 m -74.01 44.6 0.19 Allowed 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 120.904 0.383 . . . . 0.0 111.437 178.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.442 ' OE1' ' HB2' ' A' ' 7' ' ' HIS . 28.1 mt-30 -95.41 -12.95 25.1 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.588 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 73.4 m-20 62.25 165.58 0.1 Allowed 'General case' 0 C--O 1.232 0.145 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.933 -175.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.738 HG13 ' HB2' ' A' ' 58' ' ' ALA . 2.1 m -125.21 126.6 71.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.269 -176.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -103.86 103.14 12.97 Favored 'General case' 0 N--CA 1.445 -0.709 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 167.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 60.7 t -102.78 117.2 47.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-O 121.48 0.657 . . . . 0.0 111.222 -168.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.713 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 8.7 p -82.51 122.63 37.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.92 176.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.794 HD12 HD21 ' A' ' 65' ' ' LEU . 0.2 OUTLIER -104.13 111.43 24.02 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.83 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.453 ' HB3' ' CZ2' ' A' ' 19' ' ' TRP . 61.0 mttm -104.32 111.6 24.3 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.335 177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.8 tp -100.17 110.86 23.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.295 -171.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.939 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 4.7 m95 -109.87 -167.83 1.25 Allowed 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -172.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.682 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 3.7 pptp? -73.53 -38.28 65.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.925 -177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.7 m -85.69 -41.13 15.43 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.905 0.383 . . . . 0.0 110.866 -178.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.63 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -164.84 -132.2 1.33 Allowed Glycine 0 N--CA 1.445 -0.708 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.742 -177.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.663 ' CZ ' ' HB2' ' A' ' 41' ' ' PHE . 36.5 p90 -152.9 153.21 32.56 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 72.3 p -126.36 159.13 34.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.553 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.713 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.4 mp -136.62 -162.86 1.33 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -176.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -83.58 -39.89 19.78 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.722 0.772 . . . . 0.0 109.104 170.654 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -77.23 2.2 16.24 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 114.261 -1.336 . . . . 0.0 112.302 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -179.9 156.76 18.83 Favored Glycine 0 CA--C 1.504 -0.616 0 C-N-CA 120.673 -0.775 . . . . 0.0 111.531 -176.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -92.6 -163.36 1.03 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 116.467 0.133 . . . . 0.0 111.219 -175.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 1.036 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.2 OUTLIER -64.73 100.95 0.43 Allowed 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.543 0.687 . . . . 0.0 109.868 -176.172 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.476 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 4.4 mtp180 -99.05 120.57 39.68 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.882 -1.054 . . . . 0.0 108.215 173.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.63 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 16.2 m -75.56 136.83 40.53 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.776 0.322 . . . . 0.0 110.276 -174.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.47 ' CD1' ' HA2' ' A' ' 22' ' ' GLY . 21.1 m-85 -45.34 -38.21 5.59 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.863 -168.423 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -63.92 -28.59 69.93 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -176.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.622 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.9 t70 -60.66 130.42 90.41 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-O 120.947 0.403 . . . . 0.0 111.248 177.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 12.3 Cg_exo -70.83 -9.18 25.23 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 123.036 2.491 . . . . 0.0 113.674 -174.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 18.4 t -88.32 -40.13 13.83 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 110.657 -176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.622 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 9.5 p30 -81.04 -18.01 48.22 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.003 0.43 . . . . 0.0 110.53 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.33 -35.51 12.53 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.855 172.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.452 HE22 ' CG ' ' A' ' 53' ' ' GLU . 12.2 tt0 -50.65 -56.95 9.49 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.586 173.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.663 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 82.6 m-85 -59.5 -51.85 68.11 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.098 -178.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.672 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 58.3 mt -45.39 -51.28 11.51 Favored 'General case' 0 C--N 1.329 -0.287 0 O-C-N 123.635 0.584 . . . . 0.0 111.402 -177.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -72.8 -44.45 61.49 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.226 -178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.43 ' OG ' ' HG3' ' A' ' 51' ' ' PRO . 89.1 p -56.13 -44.95 79.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 120.826 0.346 . . . . 0.0 110.567 179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 75.6 mt -73.19 -35.26 46.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.201 -174.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 47.7 mtp180 -64.84 -36.69 85.16 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.709 0.29 . . . . 0.0 110.918 177.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 19.2 mmt180 -85.99 4.29 38.43 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.66 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 69.31 29.11 72.01 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.836 178.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -107.05 168.05 9.48 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.042 0.448 . . . . 0.0 110.548 179.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.543 HG11 ' HD3' ' A' ' 55' ' ' ARG . 7.7 p -91.54 121.21 67.71 Favored Pre-proline 0 N--CA 1.443 -0.815 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.01 179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.652 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 70.0 Cg_exo -53.03 136.46 61.06 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.796 2.331 . . . . 0.0 111.748 167.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.22 -23.54 65.7 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.158 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.589 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 4.6 mm-40 -64.51 -32.9 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.157 177.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -85.81 -40.15 16.32 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 121.251 0.548 . . . . 0.0 109.683 -177.747 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.543 ' HD3' HG11 ' A' ' 50' ' ' VAL . 4.0 tpt180 -64.73 -45.62 85.72 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.63 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.461 ' HD3' ' HA ' ' A' ' 56' ' ' ARG . 17.0 mmt180 -88.13 36.42 0.78 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.456 174.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 0.7 OUTLIER -120.7 -56.43 1.95 Allowed 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 168.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.738 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -77.36 178.98 6.72 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.505 -1.225 . . . . 0.0 109.29 165.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.628 ' HB2' ' HA ' ' A' ' 9' ' ' SER . 1.9 t-80 -56.67 -26.65 57.0 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.711 169.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 110.72 6.35 26.79 Favored Glycine 0 N--CA 1.442 -0.903 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.289 -176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.61 -94.31 0.24 Allowed Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.666 -178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.588 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 6.0 tt0 -84.24 83.47 7.96 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 121.755 0.788 . . . . 0.0 109.172 178.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.419 HG21 HG21 ' A' ' 50' ' ' VAL . 5.5 m -93.35 102.24 13.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.318 175.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -115.7 130.49 56.87 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.916 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.794 HD21 HD12 ' A' ' 16' ' ' LEU . 10.4 tt -123.38 128.61 50.11 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.079 -179.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.46 129.42 56.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.228 179.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.438 ' HA ' ' HB3' ' A' ' 16' ' ' LEU . 84.7 mtp -98.86 124.56 43.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.991 0.424 . . . . 0.0 112.074 -173.528 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -115.94 145.05 43.25 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -103.25 117.07 33.7 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.287 0.565 . . . . 0.0 110.045 177.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.616 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 95.2 m-70 -135.8 34.28 2.91 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.245 -0.889 . . . . 0.0 108.917 -179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.638 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 52.1 mtp180 -72.84 135.67 45.23 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.682 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.1 t70 74.07 -18.48 0.4 Allowed 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.987 0.805 . . . . 0.0 111.417 -171.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.616 ' HB3' ' O ' ' A' ' 70' ' ' HIS . 1.5 tt0 -66.67 -34.01 76.91 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.675 0.75 . . . . 0.0 109.122 170.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 69.88 165.28 0.27 Allowed 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 113.817 -1.538 . . . . 0.0 111.071 -178.373 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 1.036 ' HB2' HD12 ' A' ' 30' ' ' LEU . 9.7 t80 -66.8 90.0 0.17 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.427 -164.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.5 p -90.31 -9.27 10.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.44 176.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.766 ' HE3' ' CZ ' ' A' ' 75' ' ' PHE . 19.7 mtpt 77.51 143.74 0.1 OUTLIER Pre-proline 0 N--CA 1.464 0.233 0 CA-C-N 114.545 -1.207 . . . . 0.0 113.452 168.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.485 ' HB3' HG11 ' A' ' 15' ' ' VAL . 10.9 Cg_exo -77.85 -61.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.434 0 C-N-CA 123.085 2.524 . . . . 0.0 109.603 163.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.412 ' HG2' ' H ' ' A' ' 79' ' ' LYS . 0.9 OUTLIER -70.25 97.29 1.21 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.407 -1.27 . . . . 0.0 109.86 171.08 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 130.84 -0.62 5.41 Favored Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.247 -0.741 . . . . 0.0 111.247 -175.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -102.15 -172.57 2.16 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -110.67 -54.26 2.61 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 120.63 0.252 . . . . 0.0 110.905 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 46.7 pttt -88.2 -27.03 22.07 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.295 177.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 66.66 -67.16 0.16 Allowed 'General case' 0 N--CA 1.468 0.47 0 O-C-N 124.079 0.862 . . . . 0.0 112.305 176.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -106.51 127.58 53.42 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 2.8 m -72.43 -35.42 68.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.596 -174.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 122.83 121.41 2.68 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 41.98 35.42 0.55 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.101 0.96 . . . . 0.0 111.835 -174.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.58 -95.12 0.12 Allowed Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.561 -0.745 . . . . 0.0 111.4 -174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -176.39 43.22 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm 63.88 -141.64 0.31 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.596 -173.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 81.2 mt 71.97 -71.6 0.13 Allowed 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 122.958 0.503 . . . . 0.0 111.4 177.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -100.97 8.16 57.56 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.846 -0.693 . . . . 0.0 112.382 -176.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 p -70.39 -25.76 63.39 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.97 0.414 . . . . 0.0 111.227 -178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.9 m -154.35 136.21 14.54 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.024 -0.534 . . . . 0.0 109.863 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 66.25 84.15 0.18 Allowed Pre-proline 0 CA--C 1.533 0.304 0 O-C-N 123.737 0.648 . . . . 0.0 111.414 -179.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.561 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 33.2 Cg_endo -64.9 118.86 5.8 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.838 2.359 . . . . 0.0 112.537 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.684 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 19.8 pt20 46.27 -81.68 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.974 1.31 . . . . 0.0 113.945 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.684 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 9.6 p -122.5 0.71 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.307 0.575 . . . . 0.0 111.014 -175.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.561 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 54.4 mt -95.43 117.55 30.56 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.925 -177.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -90.06 -14.88 32.89 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.796 0.332 . . . . 0.0 110.288 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.4 p . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.367 -0.825 . . . . 0.0 111.245 -179.862 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 112.229 -0.349 . . . . 0.0 112.229 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.6 m -137.64 142.4 41.18 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 177.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.54 -50.26 1.63 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.147 178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.437 ' HE2' ' O ' ' A' ' 59' ' ' HIS . 86.8 mttt 54.69 41.82 31.66 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.753 0.787 . . . . 0.0 109.138 -175.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 10.8 tpp180 -107.9 -58.71 1.94 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.472 -177.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -132.68 -32.45 1.28 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.55 179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -92.79 41.39 1.08 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.503 0.668 . . . . 0.0 109.355 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.8 m -75.01 102.87 4.98 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.346 -0.843 . . . . 0.0 108.822 176.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.632 ' HB3' HG13 ' A' ' 12' ' ' VAL . 2.0 m -59.46 -51.73 68.64 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.665 -171.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.935 ' H ' ' HA3' ' A' ' 60' ' ' GLY . 0.0 OUTLIER 70.15 -24.26 0.16 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.085 0.954 . . . . 0.0 110.826 -177.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.609 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 1.0 OUTLIER -174.13 130.76 0.39 Allowed 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 114.642 -1.163 . . . . 0.0 109.451 177.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.632 HG13 ' HB3' ' A' ' 9' ' ' SER . 35.2 m -137.95 144.38 31.06 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.4 0.619 . . . . 0.0 110.187 172.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.1 m-70 -102.64 129.82 49.34 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.26 -0.882 . . . . 0.0 108.913 169.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 62.1 t -101.27 104.79 16.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 -177.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.732 HG11 ' HG2' ' A' ' 78' ' ' PRO . 4.2 p -68.8 103.81 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 CA-C-N 114.769 -1.105 . . . . 0.0 111.206 -177.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.864 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -107.76 114.31 28.17 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.534 178.589 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.2 mttm -104.66 136.89 43.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.727 178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.4 OUTLIER -99.62 110.84 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.795 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.9 m95 -100.77 -173.57 2.42 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.183 -175.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.52 -24.68 39.19 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.112 0.482 . . . . 0.0 110.785 178.406 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.472 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 33.4 t -100.32 -48.11 4.7 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.372 -177.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.526 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -156.11 -152.72 6.33 Favored Glycine 0 N--CA 1.441 -0.967 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.201 -177.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.5 p90 -130.36 149.0 52.25 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.622 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 22.7 t -127.06 142.59 51.49 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.623 178.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.558 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -122.21 -168.21 1.68 Allowed 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -81.34 -34.95 31.47 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 170.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.558 HD21 HD22 ' A' ' 25' ' ' LEU . 1.9 p-10 -75.82 44.67 0.31 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 114.814 -1.085 . . . . 0.0 111.295 178.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 136.69 -162.16 25.15 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.965 -0.636 . . . . 0.0 111.819 -178.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.452 ' HA ' ' OG ' ' A' ' 24' ' ' SER . 40.4 mt-10 -130.6 -166.21 1.65 Allowed 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.379 0.09 . . . . 0.0 111.213 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.795 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.8 tt -57.86 122.79 13.77 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.337 0.589 . . . . 0.0 110.975 -173.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.526 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 58.0 mtt180 -121.2 117.85 28.14 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.189 -0.914 . . . . 0.0 109.291 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 5.6 m -64.48 143.51 57.86 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.39 0.431 . . . . 0.0 111.843 -172.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.494 ' CE1' ' HD1' ' A' ' 23' ' ' PHE . 42.3 m-85 -70.13 20.97 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 112.8 0.666 . . . . 0.0 112.8 -173.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.428 ' H ' ' C ' ' A' ' 32' ' ' SER . 85.2 mm-40 -115.49 -31.4 5.91 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.931 0.396 . . . . 0.0 110.413 176.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.536 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.4 t70 -62.26 124.96 84.47 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.742 -179.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 16.8 Cg_exo -68.66 -9.96 27.66 Favored 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 123.207 2.604 . . . . 0.0 113.26 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 m -77.73 -49.1 15.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.783 0.325 . . . . 0.0 110.334 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.68 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 12.4 p30 -76.22 -15.4 60.04 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.928 0.394 . . . . 0.0 110.823 178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.25 -26.62 18.68 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.989 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.747 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -58.41 -49.88 75.7 Favored 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 173.477 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 97.4 m-85 -61.19 -52.97 62.56 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.723 -0.672 . . . . 0.0 109.75 177.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.0 mt -50.02 -43.55 50.8 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.528 -178.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.677 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.8 tt0 -71.71 -51.11 24.57 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.957 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -56.44 -45.25 80.88 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 120.934 0.397 . . . . 0.0 111.031 -178.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 41' ' ' PHE . 55.2 mt -72.38 -30.86 36.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.754 -176.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -66.34 -45.61 79.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.887 174.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.677 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 31.9 mmt180 -64.28 -37.9 89.13 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.055 0.455 . . . . 0.0 110.819 -179.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.2 9.1 13.73 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 -174.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -91.66 167.06 12.46 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.147 0.499 . . . . 0.0 110.25 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -101.08 116.53 63.82 Favored Pre-proline 0 N--CA 1.441 -0.88 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.435 175.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.747 ' HB3' HE22 ' A' ' 40' ' ' GLN . 51.2 Cg_exo -52.68 135.8 57.07 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.674 2.25 . . . . 0.0 111.946 177.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.59 -27.34 66.19 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.004 -174.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.508 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 11.6 mm-40 -61.8 -39.42 91.66 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.551 0.215 . . . . 0.0 111.352 179.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.611 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -86.81 -38.11 17.15 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.299 0.571 . . . . 0.0 109.764 -179.299 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.594 ' C ' ' HD3' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -63.65 -43.69 96.03 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.613 179.5 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.0 mmt85 -86.25 22.23 1.85 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.647 176.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.6 tt -111.09 -50.33 2.95 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 107.828 -1.175 . . . . 0.0 107.828 171.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.462 ' HB2' ' CG2' ' A' ' 12' ' ' VAL . . . -59.6 124.72 21.01 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.313 170.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' O ' ' HE2' ' A' ' 4' ' ' LYS . 30.4 m170 -99.27 -12.79 20.05 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.619 -0.718 . . . . 0.0 111.556 -175.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.935 ' HA3' ' H ' ' A' ' 10' ' ' GLN . . . -93.23 -51.8 2.16 Favored Glycine 0 CA--C 1.503 -0.662 0 C-N-CA 120.455 -0.878 . . . . 0.0 111.843 -178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 158.58 -63.57 0.3 Allowed Glycine 0 CA--C 1.494 -1.23 0 C-N-CA 120.295 -0.955 . . . . 0.0 112.661 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.609 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 8.2 tt0 -62.25 108.64 1.12 Allowed 'General case' 0 N--CA 1.435 -1.206 0 CA-C-O 121.183 0.516 . . . . 0.0 111.216 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.5 p -124.32 102.98 11.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.119 175.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -110.05 134.08 52.53 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.4 -176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.806 HD11 HD12 ' A' ' 16' ' ' LEU . 9.0 tt -104.48 129.47 52.49 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.915 0.388 . . . . 0.0 110.019 -178.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -112.32 137.04 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.941 179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 46.9 mtt -105.2 133.58 49.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.316 0.579 . . . . 0.0 111.982 -178.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.542 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 52.8 mt-10 -117.73 158.82 24.05 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.118 -0.946 . . . . 0.0 109.515 172.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 -114.96 110.77 20.13 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.589 0.709 . . . . 0.0 110.483 176.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 90.3 m-70 -138.27 59.53 1.64 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.875 -179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 58.4 mtp180 -78.65 -52.22 8.74 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.816 -174.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.58 -19.62 62.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.634 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.7 mp0 -70.43 -38.52 74.56 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.89 178.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 57.6 174.54 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.393 1.077 . . . . 0.0 111.678 -169.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 71.3 t80 -56.08 133.9 52.3 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -166.281 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.43 HG13 ' N ' ' A' ' 77' ' ' LYS . 14.2 p -148.07 -46.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 114.705 -1.134 . . . . 0.0 109.434 174.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.817 ' HB3' ' HG3' ' A' ' 79' ' ' LYS . 6.2 mtpt 64.0 164.86 0.12 Allowed Pre-proline 0 C--N 1.331 -0.212 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 176.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.732 ' HG2' HG11 ' A' ' 15' ' ' VAL . 16.9 Cg_exo -71.83 -65.37 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.512 0 C-N-CA 123.475 2.783 . . . . 0.0 110.156 170.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.817 ' HG3' ' HB3' ' A' ' 77' ' ' LYS . 53.2 mtpt 50.39 -103.91 0.14 Allowed 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.713 0.633 . . . . 0.0 112.431 177.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -118.94 6.21 13.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.679 -0.772 . . . . 0.0 111.497 179.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -105.21 -41.02 5.66 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.66 -0.27 . . . . 0.0 110.498 -179.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 52.18 53.38 12.54 Favored 'General case' 0 N--CA 1.463 0.178 0 O-C-N 123.549 0.531 . . . . 0.0 110.051 -178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.496 ' HE3' ' HB2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -66.2 -39.22 89.49 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.671 -172.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.459 ' HB3' ' HD3' ' A' ' 83' ' ' LYS . . . -169.41 159.25 8.51 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 120.956 0.408 . . . . 0.0 111.285 -178.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.1 p90 -138.6 47.2 1.97 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.083 -0.962 . . . . 0.0 109.566 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 17.7 p -97.39 127.88 43.73 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.33 -178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' A' ' 88' ' ' GLU . . . -129.02 148.09 17.98 Favored Glycine 0 N--CA 1.448 -0.531 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 174.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.473 ' HB3' ' O ' ' A' ' 87' ' ' GLY . 14.4 tp10 77.2 -40.81 0.36 Allowed 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.44 0.696 . . . . 0.0 110.731 -179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -125.33 93.91 0.44 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.161 178.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 70.7 mm-40 -83.56 -29.32 27.93 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 176.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.3 tttp -110.84 83.73 1.81 Allowed 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 114.877 -1.056 . . . . 0.0 108.583 173.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 pp -102.24 19.75 18.1 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.078 -172.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.02 65.11 0.56 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.445 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 66.1 m -124.13 177.72 5.68 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 110.791 -0.078 . . . . 0.0 110.791 178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 6.8 p 49.9 82.65 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 123.367 0.667 . . . . 0.0 111.902 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -165.42 97.73 0.81 Allowed Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.59 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 102' ' ' THR . 22.6 Cg_exo -65.0 87.48 0.18 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 123.288 2.658 . . . . 0.0 112.81 -177.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.405 ' HB3' ' H ' ' A' ' 99' ' ' VAL . 27.6 mm-40 -134.95 -154.15 0.56 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.082 178.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.405 ' H ' ' HB3' ' A' ' 98' ' ' GLN . 48.5 t -67.7 -44.48 85.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.332 0.587 . . . . 0.0 109.557 175.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 7.3 mp -105.32 161.14 14.56 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.773 177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 38.6 t 73.82 -84.16 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.182 175.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 97' ' ' PRO . 79.5 m . . . . . 0 C--O 1.251 1.18 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -167.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.539 0 N-CA-C 111.546 -0.621 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.2 m -137.35 123.85 20.86 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.714 0.293 . . . . 0.0 110.726 178.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -141.76 137.31 31.51 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.8 ptpt -84.64 130.19 34.75 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.295 0.569 . . . . 0.0 110.276 -177.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.764 ' HG3' ' H ' ' A' ' 6' ' ' GLN . 0.4 OUTLIER -86.38 -151.93 0.17 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.234 179.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.764 ' H ' ' HG3' ' A' ' 5' ' ' ARG . 5.6 mm100 -63.87 -45.67 88.4 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -176.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.5 m80 -137.47 149.79 47.1 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.102 172.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.1 p -122.21 37.27 4.42 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 120.781 0.324 . . . . 0.0 110.893 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.1 p -133.38 28.37 4.04 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 111.916 0.339 . . . . 0.0 111.916 -175.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -95.7 28.28 3.1 Favored 'General case' 0 N--CA 1.464 0.256 0 O-C-N 122.357 -0.214 . . . . 0.0 110.665 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.719 ' HA ' ' CA ' ' A' ' 62' ' ' GLN . 10.7 m-20 20.31 104.37 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.796 1.638 . . . . 0.0 113.956 -178.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.526 HG22 ' O ' ' A' ' 62' ' ' GLN . 26.7 m -59.05 164.16 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 120.995 0.426 . . . . 0.0 110.78 178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -124.72 107.8 11.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.192 0.52 . . . . 0.0 110.379 -174.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.929 HG21 HD22 ' A' ' 54' ' ' LEU . 77.4 t -104.06 114.55 43.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.966 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.342 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.843 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.3 p -85.87 129.58 37.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 122.004 0.907 . . . . 0.0 111.518 -174.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.751 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.4 OUTLIER -104.25 123.04 46.63 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.547 -1.206 . . . . 0.0 108.476 178.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.843 ' HE3' HG13 ' A' ' 15' ' ' VAL . 0.1 OUTLIER -103.23 134.59 46.39 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 176.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 71' ' ' ARG . 17.7 tp -99.94 112.92 25.18 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 115.08 -0.963 . . . . 0.0 108.521 -174.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.921 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.0 m95 -105.2 -168.45 1.47 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.429 0.633 . . . . 0.0 111.303 -171.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -70.32 -47.93 58.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.539 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.514 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 44.8 m -118.19 0.33 11.73 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.5 -173.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.495 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.47 -165.72 28.26 Favored Glycine 0 N--CA 1.44 -1.091 0 C-N-CA 120.079 -1.058 . . . . 0.0 112.163 -177.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.751 ' HB2' HD21 ' A' ' 16' ' ' LEU . 52.0 p90 -144.64 149.36 35.57 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-O 120.882 0.372 . . . . 0.0 110.053 -176.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.649 ' HB3' ' HE1' ' A' ' 19' ' ' TRP . 18.2 t -132.54 126.91 33.96 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.329 0.585 . . . . 0.0 110.723 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.625 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -112.84 157.41 21.42 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 176.78 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.781 ' HB2' HG13 ' A' ' 14' ' ' VAL . 57.2 m-20 -52.6 -14.84 0.56 Allowed 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 114.095 1.146 . . . . 0.0 114.095 -166.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.442 ' OD1' HD21 ' A' ' 54' ' ' LEU . 4.7 p-10 -88.65 -4.33 58.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -164.16 -159.15 10.67 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.27 -0.967 . . . . 0.0 113.549 -178.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -111.31 -174.43 2.47 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.532 -0.334 . . . . 0.0 110.829 -175.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.921 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -64.47 98.92 0.27 Allowed 'General case' 0 C--O 1.233 0.212 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 177.143 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.522 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 41.8 mtt180 -95.4 128.4 42.22 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 173.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.495 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 3.1 m -73.58 134.39 43.73 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -172.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -45.77 -45.11 14.4 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -170.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.28 -33.01 70.55 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 -171.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.742 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.7 t70 -62.96 132.43 94.99 Favored Pre-proline 0 C--N 1.324 -0.535 0 CA-C-O 120.974 0.416 . . . . 0.0 111.651 -175.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 44.6 Cg_exo -58.46 -18.38 38.75 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 123.786 2.991 . . . . 0.0 114.314 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 2.8 m -79.01 -27.43 43.28 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 122.082 0.944 . . . . 0.0 108.739 -179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.742 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.2 m-20 -93.55 -26.75 16.99 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 113.764 -1.562 . . . . 0.0 110.706 -172.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -54.71 -31.78 58.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.727 -0.669 . . . . 0.0 110.331 172.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.749 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.8 OUTLIER -53.06 -59.76 4.14 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.233 174.76 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.724 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 68.5 m-85 -60.21 -48.3 82.3 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.272 -178.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' A' ' 46' ' ' ARG . 69.7 mt -50.71 -52.29 41.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.462 -178.455 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 36.6 tt0 -70.32 -47.26 61.92 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.8 m -53.03 -49.3 66.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.459 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.61 HD13 HD12 ' A' ' 16' ' ' LEU . 53.9 mt -84.39 -19.31 9.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.489 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 68.6 ttt180 -73.68 -45.24 53.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.451 174.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 26.7 mmm180 -72.03 -31.8 66.52 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-O 121.134 0.493 . . . . 0.0 110.151 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.18 44.73 1.24 Allowed Glycine 0 N--CA 1.447 -0.63 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.974 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -122.07 169.19 11.09 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.12 0.486 . . . . 0.0 110.901 179.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.492 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 88.3 t -96.16 123.51 54.83 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.694 -177.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.749 ' HB3' HE22 ' A' ' 40' ' ' GLN . 17.4 Cg_exo -69.55 142.12 48.0 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.009 2.473 . . . . 0.0 112.128 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.16 -27.71 68.6 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.649 -175.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.724 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.7 mm-40 -52.54 -43.45 65.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.972 0.415 . . . . 0.0 110.651 175.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.929 HD22 HG21 ' A' ' 14' ' ' VAL . 22.2 mt -88.11 -44.21 11.1 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.845 -178.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.61 -40.52 97.14 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.051 -176.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -84.22 43.26 0.93 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.478 0.656 . . . . 0.0 109.994 174.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 tp -153.75 -49.42 0.09 Allowed 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 114.886 -1.052 . . . . 0.0 108.704 176.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.531 ' CB ' ' HB ' ' A' ' 63' ' ' VAL . . . -69.02 148.22 50.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.536 175.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 88.0 m-70 -100.18 125.93 46.39 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -175.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 71.35 15.12 74.78 Favored Glycine 0 C--O 1.229 -0.192 0 C-N-CA 121.185 -0.531 . . . . 0.0 113.373 172.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 91.88 8.6 63.32 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.484 -0.865 . . . . 0.0 112.36 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.719 ' CA ' ' HA ' ' A' ' 11' ' ' ASP . 7.2 tt0 -65.81 62.38 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 123.907 0.883 . . . . 0.0 110.096 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.531 ' HB ' ' CB ' ' A' ' 58' ' ' ALA . 2.6 p -145.21 123.69 5.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.145 0.497 . . . . 0.0 111.678 -174.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 64' ' ' ASN . 2.4 t-20 -139.71 165.16 28.02 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.8 -0.637 . . . . 0.0 109.778 171.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 16' ' ' LEU . 4.8 tt -132.76 136.72 46.52 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.852 0.358 . . . . 0.0 110.541 -179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -107.32 158.93 16.76 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 173.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.412 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 14.7 ttt -133.96 132.45 40.19 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.542 -176.208 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -113.2 164.1 13.94 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.299 178.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' A' ' 90' ' ' GLN . 20.3 t0 -117.78 116.33 26.79 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 172.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.501 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -141.58 36.8 1.65 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 67.0 mtp180 -58.86 -35.09 72.39 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 115.538 -0.756 . . . . 0.0 113.004 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -99.28 17.21 20.63 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 120.56 -0.456 . . . . 0.0 111.212 179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.501 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.0 mt-10 -100.65 -29.11 12.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.34 176.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 t70 67.7 175.92 0.26 Allowed 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.106 -168.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.895 ' HB2' HD12 ' A' ' 30' ' ' LEU . 37.5 t80 -72.34 121.78 20.05 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -166.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 76' ' ' VAL . 7.5 p -175.18 53.49 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-O 121.689 0.757 . . . . 0.0 111.888 -174.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.756 ' HG3' ' HB3' ' A' ' 83' ' ' LYS . 2.0 tppt? -133.73 -56.54 0.02 OUTLIER Pre-proline 0 CA--C 1.536 0.412 0 O-C-N 121.044 -1.035 . . . . 0.0 113.379 -177.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.649 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 39.3 Cg_exo -66.07 -41.27 13.63 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.721 2.281 . . . . 0.0 111.905 175.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -133.05 151.48 52.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.882 178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 92.74 -37.51 3.38 Favored Glycine 0 CA--C 1.511 -0.214 0 N-CA-C 111.12 -0.792 . . . . 0.0 111.12 -179.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -137.76 174.46 10.55 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 174.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -111.71 114.99 28.34 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-O 120.9 0.381 . . . . 0.0 110.864 -178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.756 ' HB3' ' HG3' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -70.41 96.96 1.2 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.484 0.659 . . . . 0.0 110.965 178.871 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -92.12 6.62 45.86 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.045 179.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 60.1 t80 64.43 102.59 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.562 -178.333 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.2 t -141.41 128.7 21.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.452 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -92.48 -42.9 4.42 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.141 179.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -92.45 137.71 32.13 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 179.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 112.36 -14.98 25.27 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.793 -0.717 . . . . 0.0 111.617 -178.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.424 ' HB3' ' O ' ' A' ' 69' ' ' ASP . 80.5 mt-30 -70.96 -74.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.009 0.433 . . . . 0.0 109.96 178.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.898 ' HG2' ' HB2' ' A' ' 94' ' ' SER . 14.0 tppt? 178.02 -61.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.158 -179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.444 HD22 ' HA ' ' A' ' 92' ' ' LEU . 0.3 OUTLIER 59.87 83.31 0.14 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.163 -179.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 115.87 41.65 0.77 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.673 -177.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.898 ' HB2' ' HG2' ' A' ' 91' ' ' LYS . 15.8 t -103.05 121.55 42.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.7 m 60.37 89.07 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 111.517 178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.433 ' HB1' ' HA ' ' A' ' 101' ' ' SER . . . -56.8 116.52 13.42 Favored Pre-proline 0 C--O 1.236 0.353 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.013 179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.836 ' HG2' ' HB2' ' A' ' 100' ' ' LEU . 50.9 Cg_endo -70.96 81.06 1.16 Allowed 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.045 2.497 . . . . 0.0 112.83 -177.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.722 ' HG3' ' H ' ' A' ' 99' ' ' VAL . 15.3 pt20 44.43 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.909 1.283 . . . . 0.0 113.711 176.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.722 ' H ' ' HG3' ' A' ' 98' ' ' GLN . 12.3 p -72.52 -26.01 23.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.978 0.418 . . . . 0.0 110.969 -176.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.836 ' HB2' ' HG2' ' A' ' 97' ' ' PRO . 55.3 mt -105.84 177.01 4.98 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.839 -177.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.433 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . 32.4 t -138.36 27.82 2.54 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.142 0.496 . . . . 0.0 109.856 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.2 t . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.142 -178.115 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.694 0 N-CA-C 112.35 -0.3 . . . . 0.0 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.8 p -97.85 54.7 1.15 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.746 0.307 . . . . 0.0 111.211 -177.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.408 ' OE1' ' HG2' ' A' ' 4' ' ' LYS . 1.9 tm-20 -59.09 -69.94 0.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.065 178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HG2' ' OE1' ' A' ' 3' ' ' GLU . 15.7 pttm -129.17 -155.04 0.67 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 77.48 -48.2 0.5 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.763 0.825 . . . . 0.0 109.813 -174.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 61.4 25.14 15.14 Favored 'General case' 0 CA--C 1.517 -0.309 0 CA-C-N 114.654 -1.157 . . . . 0.0 111.787 170.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.5 m80 -123.93 109.92 14.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.433 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 48.6 m -85.65 -24.01 27.24 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 167.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 70.5 m -84.87 68.33 10.45 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.954 -1.021 . . . . 0.0 110.133 178.183 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.607 ' HG3' ' HB2' ' A' ' 59' ' ' HIS . 9.6 mm100 -95.81 40.99 1.11 Allowed 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.617 -1.253 . . . . 0.0 107.617 173.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.47 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 8.1 p-10 -46.51 111.29 0.36 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.027 -1.442 . . . . 0.0 111.644 -174.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.589 HG22 ' HB2' ' A' ' 58' ' ' ALA . 19.2 m -144.75 165.46 12.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.344 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.517 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 16.6 m-70 -116.85 125.72 51.96 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.797 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.794 HG11 HD22 ' A' ' 54' ' ' LEU . 40.6 t -102.8 111.05 31.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.419 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.6 HG11 ' HE2' ' A' ' 83' ' ' LYS . 84.5 t -79.05 116.79 23.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.901 0 CA-C-O 121.565 0.697 . . . . 0.0 111.226 -175.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.443 HD21 ' HB2' ' A' ' 23' ' ' PHE . 7.6 tt -104.42 122.18 44.97 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.45 177.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.558 ' HE3' ' HG2' ' A' ' 83' ' ' LYS . 20.4 mttp -103.77 137.26 42.04 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.332 -0.849 . . . . 0.0 108.727 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 mt -99.37 137.81 37.35 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 -177.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.78 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 28.3 m95 -128.92 178.03 6.67 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 110.138 -0.319 . . . . 0.0 110.138 -179.125 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.491 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -65.19 -26.53 68.19 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -175.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.5 m -127.44 -3.63 6.11 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.944 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.507 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -170.11 -154.79 9.63 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 119.533 -1.318 . . . . 0.0 113.321 -175.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 38' ' ' ASN . 39.3 p90 -148.96 152.2 35.92 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.553 ' OG ' ' HG2' ' A' ' 78' ' ' PRO . 46.7 t -139.15 137.23 35.91 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.381 0.61 . . . . 0.0 110.554 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.3 OUTLIER -138.13 156.78 47.41 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.049 -168.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.457 ' HB2' HG13 ' A' ' 14' ' ' VAL . 0.8 OUTLIER -67.38 74.33 0.15 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.64 0.733 . . . . 0.0 112.242 -173.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.504 HD21 ' CD1' ' A' ' 25' ' ' LEU . 11.4 p30 178.5 -27.42 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.232 -1.349 . . . . 0.0 108.307 176.452 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -155.11 151.55 23.15 Favored Glycine 0 C--N 1.335 0.5 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.407 -179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.56 ' HB3' ' CZ ' ' A' ' 75' ' ' PHE . 1.9 mp0 -67.05 -170.59 0.12 Allowed 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 122.86 0.464 . . . . 0.0 111.829 -178.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.78 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 2.7 tt -64.64 114.99 4.78 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.627 0.727 . . . . 0.0 110.201 -177.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.507 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 27.1 mtt180 -108.53 134.99 50.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 173.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -79.11 145.82 33.55 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.751 0.31 . . . . 0.0 111.224 -172.696 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -54.7 -30.99 57.32 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -166.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -94.15 -22.98 18.12 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -167.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.806 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.5 t70 -49.77 138.25 17.71 Favored Pre-proline 0 N--CA 1.472 0.665 0 CA-C-O 121.231 0.539 . . . . 0.0 111.909 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.79 -28.84 59.61 Favored 'Trans proline' 0 C--N 1.351 0.701 0 C-N-CA 124.063 3.175 . . . . 0.0 115.019 -173.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.4 m -84.57 -28.04 26.86 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.953 0.882 . . . . 0.0 109.137 -177.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.806 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 28.2 m-20 -82.64 -23.18 34.4 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.523 -175.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.23 -29.84 58.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.434 173.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.694 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.6 OUTLIER -61.63 -47.69 84.25 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.574 176.654 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.761 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 84.2 m-85 -61.45 -60.7 3.3 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.474 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.43 HD11 ' CE2' ' A' ' 23' ' ' PHE . 9.9 mp -53.21 -44.51 68.08 Favored 'General case' 0 C--N 1.329 -0.322 0 O-C-N 123.638 0.586 . . . . 0.0 110.556 -174.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.727 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.8 tp10 -56.95 -65.89 0.54 Allowed 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.549 177.64 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.6 m -54.94 -39.95 69.43 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.85 0.357 . . . . 0.0 111.531 -176.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.418 HG13 ' O ' ' A' ' 41' ' ' PHE . 75.0 mt -71.78 -24.2 22.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.87 -176.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 91.3 mtt180 -84.18 -29.68 26.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.936 173.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.727 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.3 mmm180 -74.23 -35.14 63.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.121 0.486 . . . . 0.0 110.115 179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 108.17 3.34 33.6 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 111.015 -0.834 . . . . 0.0 111.015 -175.086 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -89.62 169.59 11.2 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.235 -0.482 . . . . 0.0 110.26 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.463 HG11 HG13 ' A' ' 63' ' ' VAL . 58.6 t -96.72 119.79 63.11 Favored Pre-proline 0 C--N 1.321 -0.651 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.26 -175.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.694 ' HB3' HE22 ' A' ' 40' ' ' GLN . 32.1 Cg_exo -59.58 134.39 57.65 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 122.887 2.391 . . . . 0.0 111.867 173.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -59.15 -31.13 68.7 Favored 'General case' 0 C--O 1.222 -0.377 0 CA-C-N 115.451 -0.795 . . . . 0.0 112.304 -173.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.761 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 8.0 mm-40 -62.76 -26.49 68.73 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.794 HD22 HG11 ' A' ' 14' ' ' VAL . 2.4 mt -85.89 -33.17 21.3 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.661 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 3.7 tmt_? -74.7 -14.53 60.75 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 113.879 -1.51 . . . . 0.0 109.13 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.1 mmm180 -83.31 6.08 21.02 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.527 168.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.664 HD23 HG22 ' A' ' 14' ' ' VAL . 29.5 tp -112.28 -56.99 2.33 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.928 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -90.41 136.91 32.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.058 174.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.607 ' HB2' ' HG3' ' A' ' 10' ' ' GLN . 0.2 OUTLIER -75.39 57.18 0.89 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.289 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 65.6 46.71 82.99 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.98 175.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -131.76 -129.94 3.09 Favored Glycine 0 N--CA 1.434 -1.449 0 C-N-CA 120.288 -0.958 . . . . 0.0 111.048 178.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 7.0 tt0 -76.6 75.51 3.29 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.805 0.812 . . . . 0.0 110.016 175.233 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.928 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 2.6 p -101.01 103.26 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 115.318 -0.855 . . . . 0.0 108.974 172.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.517 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 2.6 t-20 -117.46 143.75 45.73 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.666 -176.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.2 147.16 34.3 Favored 'General case' 0 C--N 1.315 -0.901 0 C-N-CA 120.887 -0.325 . . . . 0.0 110.179 -178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -118.02 138.78 51.98 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.229 -0.441 . . . . 0.0 109.924 177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -96.11 120.12 35.82 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 120.976 0.417 . . . . 0.0 111.472 -176.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -106.42 138.15 43.12 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.798 -0.816 . . . . 0.0 108.798 167.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.519 ' OD1' ' HD3' ' A' ' 71' ' ' ARG . 54.3 t0 -104.27 115.82 31.07 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-O 121.147 0.499 . . . . 0.0 110.225 179.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.611 ' CE1' ' HE3' ' A' ' 77' ' ' LYS . 92.5 m-70 -137.31 34.76 2.52 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.519 ' HD3' ' OD1' ' A' ' 69' ' ' ASP . 17.3 mtp180 -68.74 137.93 54.46 Favored 'General case' 0 N--CA 1.441 -0.883 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.384 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.9 t70 73.34 -3.59 2.42 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 124.03 0.831 . . . . 0.0 111.196 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 1.6 tt0 -82.71 -26.94 31.54 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.126 0.488 . . . . 0.0 109.688 173.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.583 ' O ' HG23 ' A' ' 76' ' ' VAL . 1.7 m-20 71.38 155.25 0.15 Allowed 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 114.586 -1.188 . . . . 0.0 111.77 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.67 ' HB2' ' CD1' ' A' ' 30' ' ' LEU . 9.9 t80 -58.62 120.09 8.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.574 -0.739 . . . . 0.0 112.397 -171.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.722 ' HA ' ' HE2' ' A' ' 79' ' ' LYS . 4.9 t -135.48 -46.58 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 178.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 1.029 ' HD3' ' HA ' ' A' ' 83' ' ' LYS . 65.9 mttm -70.51 -62.67 1.99 Allowed Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -157.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.731 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 50.5 Cg_exo -58.46 -9.1 6.26 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 123.188 2.592 . . . . 0.0 113.836 -177.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.722 ' HE2' ' HA ' ' A' ' 76' ' ' VAL . 48.9 mtmt -73.22 -50.41 22.57 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.067 0.461 . . . . 0.0 110.595 177.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 174.61 26.82 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.084 -0.806 . . . . 0.0 111.084 -174.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.675 ' HB3' ' HA ' ' A' ' 77' ' ' LYS . . . -124.53 -178.78 4.24 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 178.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -116.25 167.53 10.93 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 121.597 0.713 . . . . 0.0 110.76 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 1.029 ' HA ' ' HD3' ' A' ' 77' ' ' LYS . 1.4 mtpm? -82.69 -26.12 32.36 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.835 -167.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 67.07 -60.25 0.37 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 124.243 0.965 . . . . 0.0 110.728 -174.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 55.4 t80 69.45 112.46 0.05 OUTLIER 'General case' 0 C--O 1.233 0.197 0 C-N-CA 123.493 0.717 . . . . 0.0 111.545 175.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 75.1 p 54.91 85.67 0.06 Allowed 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.522 175.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 163.29 -142.46 7.88 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 119.9 -1.143 . . . . 0.0 113.605 175.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -49.33 125.58 11.29 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 123.814 0.846 . . . . 0.0 112.808 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 109.03 -25.73 17.64 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.804 176.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -97.58 151.5 20.0 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.812 0.339 . . . . 0.0 110.953 -177.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.693 ' HG3' ' O ' ' A' ' 95' ' ' THR . 78.4 tttt -73.21 -45.87 53.72 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.289 175.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 32.1 tp 68.1 4.23 4.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 114.886 -1.052 . . . . 0.0 111.257 175.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.531 ' H ' ' HG2' ' A' ' 91' ' ' LYS . . . 85.85 -13.81 55.0 Favored Glycine 0 N--CA 1.45 -0.375 0 CA-C-N 115.987 -0.552 . . . . 0.0 112.003 -176.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 18.8 m -85.23 -51.64 6.46 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.164 -177.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.693 ' O ' ' HG3' ' A' ' 91' ' ' LYS . 62.2 m -99.71 99.41 10.24 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.122 0.486 . . . . 0.0 111.442 -175.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -89.6 114.45 60.61 Favored Pre-proline 0 C--N 1.325 -0.478 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.832 178.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.648 ' HB2' ' HB2' ' A' ' 100' ' ' LEU . 79.2 Cg_endo -79.04 51.53 3.9 Favored 'Trans proline' 0 N--CA 1.463 -0.303 0 C-N-CA 122.68 2.253 . . . . 0.0 112.175 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 57.12 -92.17 0.03 OUTLIER 'General case' 0 N--CA 1.461 0.093 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.128 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.94 15.59 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.483 179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.648 ' HB2' ' HB2' ' A' ' 97' ' ' PRO . 30.6 mt -67.07 -69.42 0.31 Allowed 'General case' 0 CA--C 1.519 -0.212 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.089 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.413 ' H ' ' HG2' ' A' ' 97' ' ' PRO . 11.7 m -82.91 -107.85 0.03 OUTLIER 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 171.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 3.3 m . . . . . 0 C--O 1.246 0.911 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 172.085 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.726 0 N-CA-C 111.578 -0.609 . . . . 0.0 111.578 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 m -76.58 65.29 2.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.93 0.395 . . . . 0.0 111.612 -177.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.448 ' HG3' ' HG3' ' A' ' 4' ' ' LYS . 10.2 pt-20 -95.32 -18.85 20.45 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.307 0.575 . . . . 0.0 109.608 173.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.448 ' HG3' ' HG3' ' A' ' 3' ' ' GLU . 64.0 mttm -102.3 89.43 3.57 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.496 -0.775 . . . . 0.0 109.931 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -139.44 -72.67 0.38 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 -179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.554 ' HG3' ' H ' ' A' ' 8' ' ' SER . 23.5 tp60 64.33 114.66 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 O-C-N 124.048 0.842 . . . . 0.0 111.609 177.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -76.39 18.27 0.32 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.069 0.461 . . . . 0.0 111.626 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.554 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.9 m -94.89 -20.22 19.6 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 169.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.7 m -91.26 52.85 2.19 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.736 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -108.12 51.85 0.73 Allowed 'General case' 0 N--CA 1.445 -0.713 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 -178.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.445 ' CB ' ' HB3' ' A' ' 62' ' ' GLN . 5.6 p-10 -49.04 142.86 6.23 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.013 -1.449 . . . . 0.0 111.229 175.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.573 HG22 ' HB2' ' A' ' 58' ' ' ALA . 22.3 m -124.49 133.36 69.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-O 121.6 0.714 . . . . 0.0 109.802 174.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.54 ' HE1' ' HA ' ' A' ' 94' ' ' SER . 15.5 t-80 -104.77 100.89 10.52 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.375 -1.343 . . . . 0.0 107.375 171.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.563 HG21 HD22 ' A' ' 54' ' ' LEU . 20.2 m -103.5 122.29 55.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 121.67 0.748 . . . . 0.0 110.539 -173.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.689 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 12.6 p -80.51 128.71 38.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.795 -176.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.918 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.7 tt -114.48 117.6 31.43 Favored 'General case' 0 N--CA 1.437 -1.086 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 171.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' N ' HD23 ' A' ' 16' ' ' LEU . 59.8 mttm -102.77 135.57 44.19 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 121.413 0.625 . . . . 0.0 109.569 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 16.3 tp -100.35 110.13 22.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.38 -174.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.831 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.7 m95 -101.58 -168.15 1.51 Allowed 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.962 -172.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.477 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -81.96 -38.64 24.87 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.555 -0.458 . . . . 0.0 111.843 177.613 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.477 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 66.1 m -95.18 -33.47 12.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.7 0.286 . . . . 0.0 111.386 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.504 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -157.41 -152.44 6.34 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 119.809 -1.186 . . . . 0.0 113.696 -174.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.918 ' HB2' HD21 ' A' ' 16' ' ' LEU . 53.5 p90 -143.71 143.75 31.55 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -177.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.521 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 92.1 p -128.32 134.65 48.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 111.16 179.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.689 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.1 OUTLIER -124.96 157.02 37.12 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 179.077 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -60.43 -5.38 1.15 Allowed 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 114.048 1.129 . . . . 0.0 114.048 -164.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -93.17 -8.27 42.98 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 121.802 -0.562 . . . . 0.0 110.485 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -161.66 -161.51 11.93 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.231 -0.509 . . . . 0.0 112.192 -178.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -114.17 -172.51 2.11 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.831 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -57.95 116.12 3.29 Favored 'General case' 0 C--O 1.232 0.161 0 C-N-CA 123.581 0.752 . . . . 0.0 110.995 -176.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.647 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 63.7 mtt180 -115.76 119.81 37.26 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.089 -0.96 . . . . 0.0 110.338 177.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.504 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -64.63 145.42 56.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.027 0.441 . . . . 0.0 111.229 -179.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -67.11 -18.04 65.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.215 -172.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 80.0 mt-30 -71.39 -32.95 69.03 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.005 -175.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.667 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 11.7 t70 -71.8 129.15 88.63 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.378 -173.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 21.8 Cg_exo -65.79 -13.41 39.67 Favored 'Trans proline' 0 C--N 1.345 0.395 0 C-N-CA 123.16 2.573 . . . . 0.0 113.667 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.7 m -81.18 -29.27 34.67 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 122.11 0.957 . . . . 0.0 108.489 178.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 11.3 m-20 -86.43 -18.75 30.94 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.36 -1.291 . . . . 0.0 109.636 -178.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.48 -26.38 65.21 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.848 174.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.72 -49.98 73.58 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.106 0.479 . . . . 0.0 110.048 174.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD1' HD11 ' A' ' 25' ' ' LEU . 96.7 m-85 -62.07 -60.3 3.81 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.795 177.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 77.8 mt -49.86 -43.12 48.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.571 -177.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.623 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 33.5 tt0 -64.5 -57.64 8.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 121.003 -0.279 . . . . 0.0 110.659 -179.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 69.8 m -56.84 -41.81 78.54 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.841 0.353 . . . . 0.0 111.03 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.442 HG13 ' O ' ' A' ' 41' ' ' PHE . 85.6 mt -67.73 -34.85 70.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.89 -178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 82.1 mtp180 -75.15 -27.9 59.9 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 120.697 0.284 . . . . 0.0 111.022 176.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.4 mmm180 -74.34 -22.71 59.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.761 0.315 . . . . 0.0 110.75 177.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.05 18.44 31.68 Favored Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.499 -175.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -106.64 168.32 9.25 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.137 0.494 . . . . 0.0 110.319 -179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 8.4 p -97.61 124.81 47.11 Favored Pre-proline 0 C--N 1.317 -0.822 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.854 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.73 132.93 55.06 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.583 2.189 . . . . 0.0 111.68 175.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.02 -28.1 62.21 Favored 'General case' 0 C--O 1.216 -0.693 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.59 -176.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.47 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 12.4 mm-40 -57.67 -28.37 63.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.714 0.292 . . . . 0.0 111.675 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.659 HD21 HD12 ' A' ' 25' ' ' LEU . 8.2 mt -88.35 -43.94 11.15 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.716 0.77 . . . . 0.0 109.308 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.559 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 2.5 tmt_? -66.67 -34.33 77.63 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.374 -1.285 . . . . 0.0 109.995 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 31.1 mmt180 -86.57 33.74 0.64 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.225 0.536 . . . . 0.0 110.14 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 7.8 tt -139.19 -60.21 0.57 Allowed 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 107.008 -1.478 . . . . 0.0 107.008 174.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.573 ' HB2' HG22 ' A' ' 12' ' ' VAL . . . -63.06 164.7 8.0 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.15 166.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.93 27.95 0.37 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.603 178.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 66.23 20.9 69.71 Favored Glycine 0 N--CA 1.451 -0.305 0 CA-C-N 116.107 -0.497 . . . . 0.0 113.616 177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.06 -120.12 4.12 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.034 -1.079 . . . . 0.0 111.181 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.445 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 28.6 tt0 -65.98 83.86 0.08 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.483 0.659 . . . . 0.0 110.778 172.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.564 HG12 ' HB3' ' A' ' 58' ' ' ALA . 5.2 m -92.14 101.22 12.33 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.872 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -119.55 120.51 36.94 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.036 0.446 . . . . 0.0 111.52 -173.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.855 HD11 HD12 ' A' ' 16' ' ' LEU . 5.9 tt -105.1 123.96 48.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.458 -0.792 . . . . 0.0 109.815 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -106.56 113.66 27.3 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.126 -173.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.473 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 83.4 mtp -84.16 117.3 23.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.09 0.472 . . . . 0.0 111.277 -177.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' CD ' ' HE2' ' A' ' 70' ' ' HIS . 39.0 tt0 -111.87 142.11 44.67 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -103.03 125.38 49.75 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.213 0.53 . . . . 0.0 111.316 -173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.639 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.1 m-70 -150.09 40.23 0.79 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.714 -179.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 53.4 mtp180 -59.74 -46.42 89.2 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.254 -173.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -89.34 8.46 30.48 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.289 -0.564 . . . . 0.0 111.245 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.639 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.5 OUTLIER -89.75 -27.97 19.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.574 178.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 70.38 178.87 0.25 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 -168.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.737 ' HB2' HD12 ' A' ' 30' ' ' LEU . 5.0 t80 -73.49 77.19 1.44 Allowed 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 -163.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.7 m -89.88 84.95 2.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.898 0.856 . . . . 0.0 110.442 169.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.527 ' O ' ' HB3' ' A' ' 81' ' ' ALA . 5.7 ptpt -83.13 155.4 67.12 Favored Pre-proline 0 C--N 1.313 -0.993 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.352 -174.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -66.07 -40.33 16.19 Favored 'Trans proline' 0 CA--C 1.52 -0.184 0 C-N-CA 122.887 2.391 . . . . 0.0 110.788 172.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.0 mttm -52.13 -72.53 0.05 Allowed 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.062 -1.426 . . . . 0.0 113.157 -175.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.511 ' H ' ' HG3' ' A' ' 77' ' ' LYS . . . -100.72 -23.16 10.26 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.7 -0.762 . . . . 0.0 113.685 -172.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.527 ' HB3' ' O ' ' A' ' 77' ' ' LYS . . . -87.49 -48.94 7.54 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.353 0.576 . . . . 0.0 110.18 -179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.9 t80 66.24 15.91 10.25 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.71 168.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -138.82 72.32 1.4 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.587 0.708 . . . . 0.0 111.103 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.29 71.19 10.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 173.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -89.48 28.75 1.22 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.7 -0.682 . . . . 0.0 112.837 -169.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 9.0 t -156.35 151.46 26.39 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.926 -0.484 . . . . 0.0 111.245 -177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.535 ' HA3' ' CD ' ' A' ' 90' ' ' GLN . . . 106.02 91.85 2.24 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.773 177.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -72.93 -60.54 2.18 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.673 0.273 . . . . 0.0 111.29 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -78.34 42.81 2.21 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.551 . . . . 0.0 113.072 -175.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.535 ' CD ' ' HA3' ' A' ' 87' ' ' GLY . 36.9 mt-30 -123.39 -16.44 6.85 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.896 0.379 . . . . 0.0 110.154 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -78.68 -79.49 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.674 -176.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.417 HD13 ' HA ' ' A' ' 92' ' ' LEU . 3.5 mm? 57.65 -91.12 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 122.774 0.429 . . . . 0.0 111.779 -178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -108.14 -7.17 31.16 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.263 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.54 ' HA ' ' HE1' ' A' ' 13' ' ' HIS . 13.9 t -65.53 -26.62 67.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.531 . . . . 0.0 110.79 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 2.9 p -105.4 19.65 20.22 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.835 -0.621 . . . . 0.0 111.73 -179.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.401 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . -102.98 105.72 46.99 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.512 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 7.8 Cg_exo -73.68 -18.11 22.57 Favored 'Trans proline' 0 C--N 1.343 0.267 0 C-N-CA 123.078 2.519 . . . . 0.0 112.876 -176.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 46.4 mm-40 -139.86 121.19 14.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.058 0.456 . . . . 0.0 111.583 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 14.8 p -83.66 -20.44 9.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.722 173.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 tt -71.88 -50.86 25.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.32 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 25.7 m -114.82 106.41 14.16 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.885 177.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.616 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.591 -0.604 . . . . 0.0 111.591 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.9 p 46.25 37.98 4.59 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.665 0.786 . . . . 0.0 111.768 -178.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.22 140.77 58.91 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.913 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' HE3' ' HB3' ' A' ' 4' ' ' LYS . 18.7 mtpp -72.39 93.72 1.56 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.708 0.766 . . . . 0.0 111.198 -174.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -133.95 -60.69 0.81 Allowed 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 114.523 -1.217 . . . . 0.0 108.047 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 46.16 -90.86 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.476 0 O-C-N 124.472 1.108 . . . . 0.0 113.949 168.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.46 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 73.0 m-70 -96.36 13.05 29.02 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -171.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.8 m -78.73 60.01 2.67 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 171.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.816 ' HB2' ' H ' ' A' ' 60' ' ' GLY . 3.9 m -100.75 -16.95 17.16 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.539 -173.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.679 ' HG2' ' HG2' ' A' ' 55' ' ' ARG . 9.5 mt-30 85.6 44.49 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 167.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.686 ' N ' ' HB1' ' A' ' 58' ' ' ALA . 7.7 t70 -110.36 116.72 31.95 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-N 119.6 1.091 . . . . 0.0 111.339 171.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.465 HG13 ' CB ' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -154.34 143.66 13.64 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 O-C-N 123.578 0.549 . . . . 0.0 110.812 177.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -103.25 99.61 9.47 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 106.774 -1.565 . . . . 0.0 106.774 167.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.404 ' HA ' ' HB2' ' A' ' 26' ' ' ASP . 32.0 t -106.22 103.71 15.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.263 0.554 . . . . 0.0 110.642 -172.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -90.06 116.65 31.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.905 175.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.882 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.7 OUTLIER -102.72 117.08 33.87 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.301 -0.863 . . . . 0.0 108.963 -177.894 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.466 ' HD2' ' HD2' ' A' ' 77' ' ' LYS . 59.0 mttm -108.24 141.31 40.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.277 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.453 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.25 124.29 45.51 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 -177.05 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.944 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 19.7 m95 -116.49 -167.55 1.3 Allowed 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.97 -177.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 pptp? -80.96 -32.27 34.54 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.158 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.4 m -87.42 -41.39 13.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.793 0.33 . . . . 0.0 110.842 179.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.587 ' HA2' ' CD2' ' A' ' 33' ' ' TYR . . . -170.74 -139.2 2.69 Favored Glycine 0 N--CA 1.441 -1.003 0 C-N-CA 120.015 -1.088 . . . . 0.0 113.211 -174.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.882 ' HB2' HD21 ' A' ' 16' ' ' LEU . 51.7 p90 -139.9 136.42 33.88 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 -172.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.556 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -116.22 133.8 55.62 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 120.909 0.385 . . . . 0.0 110.573 178.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.64 ' HG ' ' HG ' ' A' ' 16' ' ' LEU . 1.7 mp -104.22 173.36 6.34 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.404 ' HB2' ' HA ' ' A' ' 14' ' ' VAL . 23.9 t70 -58.89 -36.27 74.38 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.668 0.747 . . . . 0.0 109.584 173.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.403 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -81.73 55.28 2.65 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.35 -178.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 132.57 -161.74 24.02 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.06 -1.066 . . . . 0.0 113.534 174.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -104.37 -168.6 1.51 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.352 0.501 . . . . 0.0 112.352 -174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.944 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.3 OUTLIER -64.13 109.25 1.78 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.556 179.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.777 ' HD2' ' OD1' ' A' ' 38' ' ' ASN . 21.1 mmt180 -89.11 105.85 18.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.813 175.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.462 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 14.6 m -61.57 143.61 55.73 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 120.941 0.4 . . . . 0.0 111.042 -178.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.587 ' CD2' ' HA2' ' A' ' 22' ' ' GLY . 37.6 m-85 -69.53 -18.43 63.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.245 0.832 . . . . 0.0 113.245 -169.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 76.1 mt-30 -82.94 -30.07 28.63 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -176.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.683 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 17.2 t70 -60.76 130.48 90.71 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.96 -176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.505 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 26.2 Cg_exo -64.29 -18.94 65.05 Favored 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.546 2.831 . . . . 0.0 113.991 -176.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 35.3 t -86.79 -29.17 22.5 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -178.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.777 ' OD1' ' HD2' ' A' ' 31' ' ' ARG . 14.0 m-20 -79.79 -20.25 46.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.192 -0.913 . . . . 0.0 109.963 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.63 -28.03 65.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.596 174.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.725 HE22 ' HB3' ' A' ' 51' ' ' PRO . 1.0 OUTLIER -56.01 -51.99 65.81 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.937 174.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.817 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.0 m-85 -60.19 -55.61 31.7 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.016 179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.6 mt -48.06 -50.89 26.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.08 -0.964 . . . . 0.0 112.137 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 23.4 tt0 -72.2 -45.91 58.38 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.42 -0.512 . . . . 0.0 111.833 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.1 m -60.94 -38.19 84.95 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.805 0.336 . . . . 0.0 110.618 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 82.2 mt -77.87 -28.93 15.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.732 0.777 . . . . 0.0 109.376 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -69.24 -42.41 75.69 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.87 177.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.664 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 19.7 mmt180 -71.36 -50.16 35.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.5 178.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.87 18.19 1.26 Allowed Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.804 -0.634 . . . . 0.0 112.076 -177.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -100.52 170.68 8.22 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.4 t -105.25 118.63 55.38 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.331 -176.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.725 ' HB3' HE22 ' A' ' 40' ' ' GLN . 39.4 Cg_exo -58.39 143.04 98.11 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.926 2.418 . . . . 0.0 112.622 176.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.28 -31.22 72.33 Favored 'General case' 0 C--O 1.222 -0.354 0 CA-C-N 115.218 -0.901 . . . . 0.0 112.285 -175.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.817 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 21.2 mm-40 -55.41 -39.02 69.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.442 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -87.3 -52.3 5.47 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.003 0.43 . . . . 0.0 110.229 -178.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.679 ' HG2' ' HG2' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -66.49 -39.53 88.79 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.729 -174.727 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 41.3 mmt180 -85.29 24.3 1.16 Allowed 'General case' 0 C--N 1.329 -0.317 0 O-C-N 122.145 -0.347 . . . . 0.0 111.467 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -139.53 -42.72 0.45 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.413 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.686 ' HB1' ' N ' ' A' ' 11' ' ' ASP . . . -52.19 142.48 16.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.35 -1.295 . . . . 0.0 113.107 177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.511 ' N ' ' H ' ' A' ' 11' ' ' ASP . 7.4 p80 -141.51 106.53 4.95 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 121.271 0.558 . . . . 0.0 112.243 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.816 ' H ' ' HB2' ' A' ' 9' ' ' SER . . . 151.39 -41.65 0.75 Allowed Glycine 0 C--N 1.331 0.255 0 N-CA-C 111.108 -0.797 . . . . 0.0 111.108 -178.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.52 ' H ' ' N ' ' A' ' 11' ' ' ASP . . . 107.19 18.6 10.23 Favored Glycine 0 CA--C 1.512 -0.142 0 N-CA-C 114.287 0.475 . . . . 0.0 114.287 174.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.551 ' HB3' ' OD1' ' A' ' 11' ' ' ASP . 7.9 tt0 -114.05 75.18 0.91 Allowed 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 169.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.404 HG23 ' CG2' ' A' ' 12' ' ' VAL . 7.4 p -91.56 102.81 13.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 121.333 0.587 . . . . 0.0 109.664 -177.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -124.04 147.44 47.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.516 -174.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.631 HD11 ' HB2' ' A' ' 16' ' ' LEU . 14.1 tp -131.5 121.46 24.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.994 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -104.76 164.72 11.57 Favored 'General case' 0 C--O 1.224 -0.285 0 N-CA-C 109.049 -0.722 . . . . 0.0 109.049 177.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.581 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 96.7 mtp -137.74 133.78 34.53 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.401 0.62 . . . . 0.0 112.122 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.453 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 55.9 mt-10 -129.15 166.52 19.16 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.59 -178.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -122.88 117.7 26.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.731 0.301 . . . . 0.0 110.336 178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 65.7 m-70 -143.36 43.76 1.52 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 176.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.484 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 38.8 mtm180 -51.99 -56.12 16.23 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.591 -0.732 . . . . 0.0 112.345 -175.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.9 p30 -85.69 6.8 26.02 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.696 -173.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.477 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.3 mt-10 -94.89 -27.38 15.74 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.546 172.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.5 t0 66.88 170.57 0.25 Allowed 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.394 -175.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.892 ' HB2' HD12 ' A' ' 30' ' ' LEU . 27.2 t80 -54.55 132.9 45.93 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -169.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.583 HG23 ' HD2' ' A' ' 82' ' ' PHE . 7.2 p -165.42 80.56 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 CA-C-O 121.595 0.712 . . . . 0.0 111.852 -179.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.649 ' CB ' ' HD3' ' A' ' 78' ' ' PRO . 0.0 OUTLIER -146.05 -79.94 0.01 OUTLIER Pre-proline 0 CA--C 1.549 0.906 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 168.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.749 ' HD2' ' CZ ' ' A' ' 75' ' ' PHE . 55.8 Cg_exo -56.8 -35.82 98.29 Favored 'Trans proline' 0 C--N 1.354 0.843 0 C-N-CA 123.069 2.512 . . . . 0.0 112.606 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.401 ' HE3' ' HB3' ' A' ' 79' ' ' LYS . 26.7 mtpp -34.69 -56.44 0.54 Allowed 'General case' 0 N--CA 1.47 0.566 0 O-C-N 124.433 1.083 . . . . 0.0 112.337 178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -179.1 38.2 0.08 OUTLIER Glycine 0 N--CA 1.445 -0.734 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 66.73 -78.53 0.04 OUTLIER 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.376 0.67 . . . . 0.0 110.569 -174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.583 ' HD2' HG23 ' A' ' 76' ' ' VAL . 12.5 m-85 57.51 -92.73 0.04 OUTLIER 'General case' 0 C--O 1.232 0.17 0 C-N-CA 123.362 0.665 . . . . 0.0 110.175 -176.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -97.08 -74.18 0.58 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.453 172.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.3 -80.38 0.02 OUTLIER 'General case' 0 C--O 1.233 0.229 0 O-C-N 124.026 0.828 . . . . 0.0 109.608 -169.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -166.36 116.97 0.97 Allowed 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 169.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.6 p -103.18 -17.38 15.38 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.2 -173.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 133.7 25.91 0.6 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.428 -176.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.492 ' H ' ' CD ' ' A' ' 88' ' ' GLU . 0.5 OUTLIER -93.58 123.02 36.62 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 178.514 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -57.69 116.45 8.17 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.547 -0.751 . . . . 0.0 112.742 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -68.99 120.62 15.15 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 25.3 tptp 67.87 21.38 9.06 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 121.621 0.724 . . . . 0.0 110.562 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 41.8 tp -87.71 63.74 7.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.251 0.548 . . . . 0.0 109.526 176.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 89.96 130.59 4.25 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.942 -177.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 67.2 m -68.22 115.2 7.42 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.003 0.43 . . . . 0.0 110.947 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 20.1 p -80.33 74.01 7.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.765 178.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.71 90.46 48.24 Favored Pre-proline 0 C--N 1.325 -0.485 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.552 -177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.707 ' HG2' ' HB3' ' A' ' 100' ' ' LEU . 59.6 Cg_endo -74.18 91.04 0.96 Allowed 'Trans proline' 0 N--CA 1.462 -0.369 0 C-N-CA 122.354 2.036 . . . . 0.0 111.523 173.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 82.8 mt-30 70.0 -80.48 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.538 -0.756 . . . . 0.0 111.275 178.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 24.1 m -135.82 18.51 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 121.027 0.442 . . . . 0.0 111.391 -177.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.743 ' HG ' ' H ' ' A' ' 101' ' ' SER . 12.6 tp -122.08 -176.48 3.36 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.216 -178.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.743 ' H ' ' HG ' ' A' ' 100' ' ' LEU . 69.4 m -130.25 103.98 7.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.717 177.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.425 ' HB ' ' O ' ' A' ' 101' ' ' SER . 12.6 t . . . . . 0 C--O 1.248 1.004 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.681 0 N-CA-C 111.433 -0.667 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.6 t 66.73 36.39 4.68 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 121.56 0.695 . . . . 0.0 110.218 177.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.92 -163.98 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.582 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.8 pttt -138.31 43.92 2.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.29 0.567 . . . . 0.0 111.003 -179.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -131.15 -68.33 0.67 Allowed 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.249 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -144.22 110.32 5.42 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.375 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -85.21 31.1 0.57 Allowed 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.819 0.342 . . . . 0.0 111.143 -173.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 27.1 m -87.88 38.4 0.84 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.731 0.3 . . . . 0.0 111.082 -176.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.7 m -153.09 41.99 0.58 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.796 0.331 . . . . 0.0 111.2 -178.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -77.45 -43.05 33.69 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 175.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.553 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 6.3 m-20 52.2 88.78 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.23 0 O-C-N 124.057 0.848 . . . . 0.0 112.051 174.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.981 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -66.2 111.9 1.85 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 CA-C-O 121.552 0.691 . . . . 0.0 112.102 -175.213 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 38.7 m80 -101.11 101.91 12.75 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 106.075 -1.824 . . . . 0.0 106.075 162.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.605 HG21 HD22 ' A' ' 54' ' ' LEU . 36.0 t -103.16 108.74 25.06 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.779 -166.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.5 p -79.92 113.18 18.93 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.854 0.835 . . . . 0.0 110.252 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.727 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.8 OUTLIER -103.14 116.0 31.66 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 114.705 -1.134 . . . . 0.0 108.093 176.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.556 ' HD2' ' HB2' ' A' ' 77' ' ' LYS . 92.9 mttt -104.55 137.74 41.94 Favored 'General case' 0 N--CA 1.436 -1.132 0 CA-C-O 121.64 0.733 . . . . 0.0 109.986 178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.514 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 10.0 tp -100.57 105.51 16.93 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.725 -172.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.742 ' HE1' ' HB2' ' A' ' 24' ' ' SER . 36.4 m95 -93.66 -167.88 1.78 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.557 -175.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -83.66 -34.59 24.97 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.952 -0.299 . . . . 0.0 111.795 -178.766 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.43 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 2.6 p -95.17 -31.15 13.66 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.883 0.373 . . . . 0.0 111.385 -177.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.565 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -166.22 -145.44 4.45 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.671 -177.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.727 ' HB2' HD21 ' A' ' 16' ' ' LEU . 55.1 p90 -139.83 155.91 47.01 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 -176.218 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.742 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 34.1 t -134.43 137.56 44.1 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.114 -179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.473 HD22 HD21 ' A' ' 27' ' ' ASN . 1.6 mp -104.28 173.63 6.22 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.565 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 35.1 t70 -65.93 -24.38 66.81 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 119.864 -0.734 . . . . 0.0 109.529 174.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.473 HD21 HD22 ' A' ' 25' ' ' LEU . 1.2 p-10 -91.87 -15.04 28.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 114.665 -1.152 . . . . 0.0 112.572 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -150.0 152.06 24.04 Favored Glycine 0 C--O 1.227 -0.317 0 C-N-CA 120.143 -1.027 . . . . 0.0 112.814 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -79.14 -175.36 4.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.591 0.234 . . . . 0.0 111.03 -173.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.572 HD13 ' HD1' ' A' ' 19' ' ' TRP . 2.6 tp -63.78 111.32 2.39 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 121.799 0.809 . . . . 0.0 111.007 177.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.445 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 37.5 mtp85 -111.93 120.56 42.34 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.592 -1.185 . . . . 0.0 109.307 174.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.565 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 1.2 m -67.56 128.89 38.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.005 -176.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -45.37 -31.09 1.5 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -168.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -60.98 -33.21 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 123.326 0.65 . . . . 0.0 112.602 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.79 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 20.8 t70 -62.96 134.95 95.94 Favored Pre-proline 0 N--CA 1.47 0.558 0 CA-C-O 120.958 0.409 . . . . 0.0 111.625 -175.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 35.0 Cg_exo -62.1 -16.79 52.63 Favored 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 123.451 2.768 . . . . 0.0 113.748 -176.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.2 m -80.33 -27.73 38.28 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 122.078 0.942 . . . . 0.0 108.663 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.79 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 19.6 m-20 -82.15 -27.86 32.49 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 114.178 -1.374 . . . . 0.0 110.237 -177.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.97 -34.83 57.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.54 172.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -56.8 -60.42 3.59 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.131 174.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.598 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 96.4 m-85 -56.34 -59.16 5.36 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.394 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.531 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 90.0 mt -49.16 -48.41 44.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.647 -0.706 . . . . 0.0 112.195 -173.373 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 17.8 mt-10 -69.35 -43.86 72.77 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.428 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.408 ' HB3' ' HB2' ' A' ' 49' ' ' GLU . 71.7 m -61.96 -42.71 99.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-O 121.037 0.446 . . . . 0.0 110.337 177.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 41' ' ' PHE . 79.5 mt -68.76 -27.12 34.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.764 -178.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 99.5 mtt180 -69.72 -47.41 63.22 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.498 174.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.579 ' HB2' ' HG3' ' A' ' 49' ' ' GLU . 29.0 mmm180 -78.35 -6.77 56.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.096 -174.26 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.73 23.16 56.67 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.338 -0.935 . . . . 0.0 111.571 -177.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.579 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 43.5 mt-10 -89.69 173.02 8.52 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.716 HG13 HD12 ' A' ' 54' ' ' LEU . 74.0 t -116.67 116.28 38.77 Favored Pre-proline 0 C--N 1.32 -0.686 0 C-N-CA 120.878 -0.329 . . . . 0.0 111.615 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -54.98 138.82 79.14 Favored 'Trans proline' 0 C--O 1.236 0.38 0 C-N-CA 122.821 2.347 . . . . 0.0 111.675 170.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.46 -20.16 66.01 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.797 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.598 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 10.2 mp0 -58.89 -28.62 66.34 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.065 177.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.716 HD12 HG13 ' A' ' 50' ' ' VAL . 2.6 mt -87.38 -55.35 3.84 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.434 0.635 . . . . 0.0 109.826 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.586 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -73.08 -45.0 59.78 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.737 -172.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 56' ' ' ARG . 14.4 mmt180 -85.75 38.0 0.73 Allowed 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.214 0.53 . . . . 0.0 110.168 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -135.43 -59.27 0.77 Allowed 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.034 -1.099 . . . . 0.0 108.034 175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.981 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -75.34 139.94 42.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.471 174.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -98.51 129.79 45.09 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.273 172.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 140.25 -42.29 1.22 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.649 -177.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 114.72 -29.25 7.62 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.203 175.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.553 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 0.1 OUTLIER -60.38 118.33 6.32 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 179.451 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.734 ' HA ' HG23 ' A' ' 12' ' ' VAL . 6.5 m -131.18 104.06 8.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.305 0.574 . . . . 0.0 110.958 178.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -124.48 124.17 41.7 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.244 177.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 16' ' ' LEU . 18.8 tp -111.38 117.87 34.27 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.2 0.524 . . . . 0.0 110.234 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -103.85 151.77 22.71 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.437 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 86.8 mtp -129.67 113.53 14.89 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.546 ' OE1' ' HE2' ' A' ' 17' ' ' LYS . 90.7 mt-10 -105.33 150.96 24.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.288 174.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.514 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.1 p-10 -104.39 127.67 52.11 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.331 0.586 . . . . 0.0 109.813 176.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.675 ' HB3' ' HB3' ' A' ' 73' ' ' GLU . 93.3 m-70 -149.9 47.64 0.93 Allowed 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -179.206 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.489 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 30.9 mtp180 -67.34 -52.82 35.61 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.84 -170.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.463 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 31.1 p-10 -84.88 6.29 25.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.485 0.66 . . . . 0.0 109.96 178.186 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.675 ' HB3' ' HB3' ' A' ' 70' ' ' HIS . 2.5 tp10 -80.77 -29.81 36.13 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.757 176.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 72.3 173.49 0.3 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.17 -173.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.757 ' CE2' ' HE2' ' A' ' 79' ' ' LYS . 19.6 t80 -72.46 103.56 3.52 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.985 -0.552 . . . . 0.0 112.346 -166.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' HG13 ' A' ' 76' ' ' VAL . 5.6 p -146.59 86.26 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-O 121.849 0.833 . . . . 0.0 111.954 178.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.863 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -131.33 -55.05 0.03 OUTLIER Pre-proline 0 C--N 1.327 -0.398 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 169.228 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.863 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 2.8 Cg_exo -82.52 -127.87 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 123.965 3.11 . . . . 0.0 110.094 170.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.757 ' HE2' ' CE2' ' A' ' 75' ' ' PHE . 73.7 mmtt 64.16 -80.11 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 122.864 0.466 . . . . 0.0 112.104 176.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 154.16 -85.15 0.14 Allowed Glycine 0 N--CA 1.445 -0.716 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -177.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.38 155.44 40.64 Favored 'General case' 0 N--CA 1.444 -0.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.053 178.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -90.03 102.11 14.82 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 115.527 -0.761 . . . . 0.0 111.327 -173.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 75' ' ' PHE . 20.8 ptmt -90.95 19.84 5.31 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.335 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.434 ' HA ' ' HG3' ' A' ' 73' ' ' GLU . . . -56.16 111.81 1.05 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.294 -178.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.722 ' HE2' ' HG2' ' A' ' 88' ' ' GLU . 52.0 t80 -94.54 -84.55 0.32 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.243 -0.435 . . . . 0.0 112.001 -175.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.414 ' H ' ' HA ' ' A' ' 73' ' ' GLU . 97.1 m 69.81 137.3 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.291 0.567 . . . . 0.0 111.161 -173.445 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 128.71 6.89 4.43 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.595 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.722 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 8.5 mm-40 -120.15 1.97 10.87 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.798 0.333 . . . . 0.0 111.399 -179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -159.7 -47.32 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.27 -0.966 . . . . 0.0 113.033 178.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -80.8 -1.48 43.21 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.94 0.4 . . . . 0.0 111.062 -173.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.57 -33.15 68.83 Favored 'General case' 0 N--CA 1.448 -0.563 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 169.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 13.7 mt 59.83 -74.9 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.108 1.151 . . . . 0.0 114.108 168.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -78.66 -150.49 5.09 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.164 -0.541 . . . . 0.0 112.558 -178.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 16.5 p 50.55 62.76 2.52 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.403 0.621 . . . . 0.0 111.222 -178.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.5 p -130.24 173.82 10.42 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.503 -177.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -104.29 104.23 43.21 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.727 -179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.29 -21.27 15.5 Favored 'Trans proline' 0 C--N 1.343 0.254 0 C-N-CA 122.752 2.301 . . . . 0.0 112.559 -178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -145.86 -159.81 1.06 Allowed 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.546 HG23 HD12 ' A' ' 100' ' ' LEU . 18.3 m -61.36 -24.03 32.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.179 0 CA-C-O 120.781 0.324 . . . . 0.0 111.16 175.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.546 HD12 HG23 ' A' ' 99' ' ' VAL . 11.1 mp -93.3 135.8 34.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 173.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 28.9 p -85.75 23.59 1.4 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -170.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.245 178.392 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.71 0 N-CA-C 112.124 -0.39 . . . . 0.0 112.124 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 62.2 34.53 16.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.394 0.616 . . . . 0.0 110.123 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -144.39 124.58 13.72 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.332 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.8 mmmp? -74.09 88.64 1.93 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -75.82 162.3 28.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.851 0.834 . . . . 0.0 112.487 -172.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -150.22 -167.73 2.91 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.328 -1.305 . . . . 0.0 108.263 -179.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.2 t-80 -87.3 48.27 1.62 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.432 0.634 . . . . 0.0 110.059 -179.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.7 p -96.07 4.03 52.88 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.046 177.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 m -81.74 53.88 2.27 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.181 177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -94.24 22.05 6.34 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.645 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 70.7 m-20 63.0 174.29 0.15 Allowed 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.27 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.949 ' HB ' ' HA ' ' A' ' 63' ' ' VAL . 2.2 t -123.29 102.33 11.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.436 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -112.46 103.08 11.16 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 172.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.572 HG12 ' HB3' ' A' ' 26' ' ' ASP . 1.9 m -115.47 113.57 43.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.737 0.78 . . . . 0.0 111.32 -173.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.495 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 9.5 p -80.63 128.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.068 177.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.505 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.1 tt -119.98 115.1 23.08 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.186 176.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HB3' ' CD2' ' A' ' 70' ' ' HIS . 56.9 mttm -104.28 141.35 36.45 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.679 -0.691 . . . . 0.0 109.743 -177.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.728 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -99.24 127.62 45.25 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 108.763 -0.828 . . . . 0.0 108.763 -176.292 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.876 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 48.6 m95 -117.25 -174.56 2.62 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.256 -0.884 . . . . 0.0 110.547 -174.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.618 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.62 -26.59 55.11 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.63 177.324 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.618 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 24.7 t -107.31 -41.88 4.99 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.576 -176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.62 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.22 -145.26 4.2 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.283 -0.961 . . . . 0.0 113.196 -176.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.595 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 47.5 p90 -138.9 145.49 39.97 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.736 0.303 . . . . 0.0 110.374 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.553 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 46.7 t -118.83 134.45 55.15 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 178.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.647 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.0 OUTLIER -110.04 172.54 6.8 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.572 ' HB3' HG12 ' A' ' 14' ' ' VAL . 17.3 t70 -57.84 -27.83 63.56 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.647 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -82.27 -35.36 28.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.35 -174.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.38 -158.9 8.42 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 119.768 -1.206 . . . . 0.0 113.4 -171.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -110.05 -170.1 1.59 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.486 -176.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.876 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -61.68 106.38 0.66 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 177.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.595 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 46.1 mtt180 -100.66 115.8 31.07 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.373 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.62 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.7 OUTLIER -63.07 149.36 45.29 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.904 0.482 . . . . 0.0 112.26 -171.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.595 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 40.7 m-85 -75.13 48.29 0.4 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.867 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -141.69 -53.53 0.44 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.644 -174.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.54 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 16.2 t70 -55.65 134.12 71.75 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.531 -179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 34.9 Cg_exo -58.51 -22.62 60.38 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.646 2.898 . . . . 0.0 113.718 -176.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 13.7 m -77.08 -27.63 54.28 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 121.655 0.741 . . . . 0.0 109.479 -179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.595 ' CG ' ' HB3' ' A' ' 31' ' ' ARG . 10.9 m-20 -84.46 -25.87 28.61 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.95 -1.023 . . . . 0.0 109.641 179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.01 -32.51 67.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.28 172.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.476 ' HB3' ' O ' ' A' ' 37' ' ' SER . 13.2 tt0 -49.34 -58.62 4.76 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.482 174.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.853 ' HZ ' ' HG3' ' A' ' 53' ' ' GLU . 70.6 m-85 -62.83 -54.53 37.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.403 -0.817 . . . . 0.0 110.49 -177.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 71.3 mt -46.32 -54.08 9.63 Favored 'General case' 0 C--N 1.329 -0.294 0 O-C-N 123.7 0.625 . . . . 0.0 111.642 -175.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 21.7 mm-40 -70.3 -48.16 57.93 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.925 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.2 m -53.09 -46.19 68.54 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 123.292 0.37 . . . . 0.0 111.586 179.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 76.0 mt -75.0 -29.65 22.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.506 -175.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 88.6 mtt180 -64.94 -47.11 78.84 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.006 0.431 . . . . 0.0 110.094 171.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.716 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.1 mmt180 -65.69 -33.44 75.89 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.219 -178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.59 10.65 30.61 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 111.516 -0.634 . . . . 0.0 111.516 -178.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -90.82 163.91 14.26 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.482 . . . . 0.0 110.802 -178.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.2 p -94.96 119.65 65.6 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.871 -175.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.608 ' HD2' HD12 ' A' ' 54' ' ' LEU . 13.4 Cg_exo -70.54 137.82 34.03 Favored 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 123.07 2.513 . . . . 0.0 111.731 173.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -64.52 -23.33 67.24 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.065 -175.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.853 ' HG3' ' HZ ' ' A' ' 41' ' ' PHE . 10.5 mm-40 -65.94 -26.83 67.77 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.854 0.359 . . . . 0.0 111.169 179.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.608 HD12 ' HD2' ' A' ' 51' ' ' PRO . 8.0 mt -90.0 -49.37 6.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 122.086 0.946 . . . . 0.0 109.193 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.563 ' HD3' ' HA3' ' A' ' 60' ' ' GLY . 2.5 tmt_? -67.93 -55.32 13.21 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 113.923 -1.49 . . . . 0.0 111.067 -174.314 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -86.02 38.62 0.77 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.163 0.506 . . . . 0.0 111.025 176.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.646 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 1.5 tm? -117.93 -52.52 2.42 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 106.431 -1.692 . . . . 0.0 106.431 167.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.553 ' CB ' HG22 ' A' ' 12' ' ' VAL . . . -84.03 -174.11 5.1 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.179 -1.373 . . . . 0.0 109.69 166.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -62.97 -23.32 67.36 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.069 171.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.563 ' HA3' ' HD3' ' A' ' 55' ' ' ARG . . . 89.46 27.67 21.85 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.353 179.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -80.99 -102.22 0.33 Allowed Glycine 0 CA--C 1.506 -0.523 0 C-N-CA 120.928 -0.653 . . . . 0.0 111.646 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 -76.48 87.08 3.21 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 115.221 -0.489 . . . . 0.0 109.952 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.949 ' HA ' ' HB ' ' A' ' 12' ' ' VAL . 38.2 t -89.67 102.54 13.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.219 0.533 . . . . 0.0 109.957 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -121.39 123.47 42.19 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.17 -179.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.4 OUTLIER -115.73 150.87 36.15 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 120.784 0.326 . . . . 0.0 110.242 177.66 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.0 m-20 -126.14 132.2 51.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.105 -0.498 . . . . 0.0 109.929 174.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.488 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 88.9 mtp -102.54 122.45 44.4 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.902 0.382 . . . . 0.0 111.143 -178.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 43.8 mt-10 -108.26 165.06 11.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.003 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -116.29 113.02 22.4 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.256 176.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.526 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.3 m-70 -121.86 -59.04 1.7 Allowed 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 63.0 mtp180 60.9 -75.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.275 -0.875 . . . . 0.0 113.33 171.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -71.77 -3.75 23.83 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 120.926 0.393 . . . . 0.0 111.214 -176.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.526 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.4 mt-10 -84.16 5.32 26.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 173.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 19' ' ' TRP . 38.5 t70 58.15 -96.64 0.07 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.52 0.728 . . . . 0.0 111.422 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.696 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.5 t80 -138.39 134.19 33.82 Favored 'General case' 0 C--N 1.309 -1.158 0 O-C-N 123.68 0.612 . . . . 0.0 110.803 171.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.415 ' O ' HG13 ' A' ' 76' ' ' VAL . 7.0 p -173.13 96.84 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-O 121.599 0.714 . . . . 0.0 112.11 176.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.819 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 0.8 OUTLIER -141.02 -62.62 0.02 OUTLIER Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.678 169.69 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.819 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 25.8 Cg_exo -66.58 -42.55 9.23 Favored 'Trans proline' 0 N--CA 1.474 0.348 0 C-N-CA 122.757 2.305 . . . . 0.0 111.362 176.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -65.93 -4.34 6.81 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.708 174.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -135.06 39.83 1.64 Allowed Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 110.958 -0.857 . . . . 0.0 110.958 177.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 65.14 -79.57 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.665 0.786 . . . . 0.0 111.076 -175.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 45.5 p90 -154.42 -5.48 0.16 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.768 176.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 mmmm 50.59 93.27 0.02 OUTLIER 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.928 -171.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -49.79 133.64 21.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 170.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 17.5 p90 -72.17 64.35 0.55 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.842 0.83 . . . . 0.0 112.577 -167.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -149.67 76.0 1.29 Allowed 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -80.31 101.07 1.96 Allowed Glycine 0 N--CA 1.443 -0.898 0 CA-C-N 115.372 -0.831 . . . . 0.0 112.581 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -57.13 -41.41 79.0 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 173.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -100.95 47.88 1.18 Allowed Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.413 -0.675 . . . . 0.0 111.413 174.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -129.68 -75.52 0.55 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.175 -178.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -108.2 -13.2 14.96 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.401 178.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 92' ' ' LEU . 27.6 tp 64.49 28.68 13.45 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.932 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -178.27 131.34 1.73 Allowed Glycine 0 N--CA 1.446 -0.653 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.625 179.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.0 m -86.45 -20.39 28.21 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.877 0.37 . . . . 0.0 110.614 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.0 m -108.88 84.81 1.99 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.2 0.524 . . . . 0.0 110.225 179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -162.79 86.94 1.37 Allowed Pre-proline 0 C--N 1.323 -0.553 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.846 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -62.86 -72.17 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.764 2.309 . . . . 0.0 112.523 -178.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -176.57 -89.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 13.2 t 49.83 -96.49 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 C-N-CA 123.613 0.765 . . . . 0.0 112.284 176.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.8 tp -168.42 -67.33 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 19.6 m -99.13 -178.41 3.92 Favored 'General case' 0 N--CA 1.444 -0.725 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.016 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.677 -0.678 . . . . 0.0 110.331 -179.734 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.634 0 N-CA-C 111.766 -0.533 . . . . 0.0 111.766 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.4 t -142.42 149.23 39.03 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.055 0.455 . . . . 0.0 110.594 -176.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -100.08 -13.15 19.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.023 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt 55.03 73.57 0.41 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.296 -0.865 . . . . 0.0 110.722 -179.561 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 36.4 mmt180 -101.38 169.78 8.66 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.889 -176.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -125.93 -63.84 1.09 Allowed 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.5 m80 -157.67 -37.97 0.07 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.129 174.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 64.3 m 65.48 3.12 2.24 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 114.089 1.144 . . . . 0.0 114.089 170.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 m -140.3 39.72 1.91 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.216 0.531 . . . . 0.0 110.644 175.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -87.26 -24.33 24.41 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.501 -176.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.4 p30 55.74 161.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.608 1.163 . . . . 0.0 113.536 178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.89 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.0 OUTLIER -116.56 112.26 38.66 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.582 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.441 169.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 20.3 m80 -103.89 101.37 11.17 Favored 'General case' 0 C--N 1.31 -1.13 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.802 HG11 HD22 ' A' ' 54' ' ' LEU . 13.1 m -108.04 106.45 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 121.906 0.86 . . . . 0.0 111.158 -172.411 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.572 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 4.9 p -74.32 121.37 25.41 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.406 172.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.776 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.78 115.22 30.08 Favored 'General case' 0 N--CA 1.438 -1.069 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 178.785 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HE2' ' HE2' ' A' ' 77' ' ' LYS . 58.0 mttm -103.62 132.71 49.63 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.622 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 33.1 tp -99.88 124.16 44.89 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 -173.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.847 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.6 m95 -116.3 -170.04 1.73 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.278 0.561 . . . . 0.0 112.059 -171.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.97 -38.05 53.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.009 178.834 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.504 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 60.1 m -100.56 -30.38 11.82 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.572 0.225 . . . . 0.0 111.551 -178.069 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.51 -150.57 6.42 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.302 -0.951 . . . . 0.0 112.593 -174.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.776 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.3 p90 -142.18 148.18 37.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.72 0.295 . . . . 0.0 110.872 -175.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.45 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 29.8 t -125.91 138.31 53.78 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.28 0.562 . . . . 0.0 111.369 178.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -120.72 177.72 4.97 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 177.168 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.717 ' HB3' HG12 ' A' ' 14' ' ' VAL . 23.4 t70 -55.7 -30.18 60.69 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.313 0.578 . . . . 0.0 111.796 -175.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.472 ' OD1' HD12 ' A' ' 25' ' ' LEU . 4.1 p-10 -92.05 -27.28 17.89 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.531 -175.647 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.42 143.83 15.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.007 -1.092 . . . . 0.0 113.382 -169.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -71.54 -174.51 1.11 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 122.906 0.483 . . . . 0.0 111.743 -179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.866 HD12 ' HB2' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -60.98 99.6 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.301 176.734 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.556 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 26.0 mtp180 -100.32 121.6 41.76 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.491 ' HA ' ' O ' ' A' ' 21' ' ' SER . 29.7 t -63.76 133.35 53.33 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 123.563 0.539 . . . . 0.0 110.585 -177.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.58 -18.92 22.26 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 123.658 0.599 . . . . 0.0 111.129 -173.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.416 HE21 ' HB2' ' A' ' 34' ' ' GLN . 15.8 mt-30 -69.01 -27.72 65.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.352 179.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.653 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 3.6 t70 -71.88 127.91 90.1 Favored Pre-proline 0 C--N 1.323 -0.58 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.01 -179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 10.3 Cg_exo -72.86 -4.52 15.53 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 123.004 2.47 . . . . 0.0 113.897 -177.224 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.486 ' HB2' ' NH2' ' A' ' 31' ' ' ARG . 49.8 m -89.07 -38.54 14.29 Favored 'General case' 0 C--N 1.33 -0.277 0 O-C-N 122.005 -0.434 . . . . 0.0 110.425 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.653 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 12.2 p30 -81.27 -14.07 57.8 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 110.237 174.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -53.46 -27.87 27.3 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.693 170.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.64 -51.9 65.63 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.961 -0.563 . . . . 0.0 109.542 172.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.646 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 85.4 m-85 -60.33 -55.35 34.68 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.586 -0.733 . . . . 0.0 109.981 178.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 76.7 mt -48.97 -43.08 39.59 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.138 -179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.63 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 40.4 tt0 -67.4 -60.72 2.35 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.653 179.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.8 m -57.64 -42.54 83.65 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.704 0.288 . . . . 0.0 111.406 -176.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 72.0 mt -73.52 -32.64 36.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.225 -174.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 5.2 ptm180 -73.58 -24.25 60.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 120.15 -0.62 . . . . 0.0 109.937 176.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.63 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 22.8 mmm180 -80.74 -17.64 50.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.164 174.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 85.85 16.96 62.4 Favored Glycine 0 N--CA 1.452 -0.294 0 N-CA-C 111.552 -0.619 . . . . 0.0 111.552 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -102.2 171.51 7.44 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.957 0.408 . . . . 0.0 110.502 -177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.737 HG23 HG11 ' A' ' 63' ' ' VAL . 7.1 p -89.01 125.33 62.71 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.818 -177.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.56 137.02 35.03 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.656 2.237 . . . . 0.0 110.976 169.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.81 -18.0 65.03 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.787 -175.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.646 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 34.3 mm-40 -66.64 -28.79 68.76 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.477 179.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.802 HD22 HG11 ' A' ' 14' ' ' VAL . 1.1 mt -87.21 -47.06 9.17 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.798 0.808 . . . . 0.0 109.078 179.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 55' ' ' ARG . 1.4 tpp180 -62.48 -56.29 19.56 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.434 -1.257 . . . . 0.0 110.918 -178.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 56' ' ' ARG . 19.9 tpt180 -82.76 50.76 1.75 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.868 0.842 . . . . 0.0 110.248 174.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 53' ' ' GLU . 40.9 tp -141.92 -57.62 0.47 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.785 -1.098 . . . . 0.0 108.565 169.221 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.89 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -63.93 142.73 58.3 Favored 'General case' 0 CA--C 1.515 -0.377 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.757 175.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -94.57 99.43 11.58 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 170.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 152.5 -40.65 0.72 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.096 -178.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 94.15 -1.57 67.64 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.745 -0.741 . . . . 0.0 113.201 176.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -79.84 115.09 19.24 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 175.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.737 HG11 HG23 ' A' ' 50' ' ' VAL . 54.5 t -122.83 115.26 45.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.518 -174.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -125.62 127.84 46.94 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.509 176.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.437 HD11 HD12 ' A' ' 16' ' ' LEU . 8.0 tt -121.2 137.51 54.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.03 0.443 . . . . 0.0 110.887 -179.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -122.78 155.95 35.5 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 49.3 mtt -122.13 145.28 48.33 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.477 0.656 . . . . 0.0 112.397 -177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -135.84 132.81 37.11 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.64 -1.163 . . . . 0.0 108.133 171.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 8.6 p-10 -103.93 111.34 23.84 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.689 0.757 . . . . 0.0 110.631 179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.403 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 76.8 m-70 -109.1 -53.27 2.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.15 -0.932 . . . . 0.0 108.93 -179.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.679 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 59.2 mtm180 49.83 -80.51 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.215 1.406 . . . . 0.0 114.398 173.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -60.81 -8.37 3.0 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.794 0.33 . . . . 0.0 111.873 -178.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.403 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 23.9 mt-10 -70.87 -98.42 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.382 170.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -178.18 -98.74 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.742 0.305 . . . . 0.0 110.809 177.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.866 ' HB2' HD12 ' A' ' 30' ' ' LEU . 19.2 t80 -156.71 137.5 13.35 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.613 169.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.424 HG13 ' HB1' ' A' ' 84' ' ' ALA . 7.3 p -163.89 120.26 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.708 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.227 177.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.772 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 28.1 ttmt -173.33 -70.81 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.615 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.432 170.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.772 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 32.2 Cg_exo -62.64 -40.03 40.12 Favored 'Trans proline' 0 C--N 1.351 0.687 0 C-N-CA 122.307 2.004 . . . . 0.0 109.9 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.413 ' HG3' ' O ' ' A' ' 79' ' ' LYS . 13.9 ptmm? -97.61 74.01 2.39 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 114.461 -1.245 . . . . 0.0 110.2 172.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -140.3 -169.57 11.74 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.678 -0.773 . . . . 0.0 111.508 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -89.66 -60.48 1.93 Allowed 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 79.0 t80 -154.5 -63.52 0.13 Allowed 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.155 175.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -105.71 103.24 12.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.525 0.678 . . . . 0.0 110.314 178.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.424 ' HB1' HG13 ' A' ' 76' ' ' VAL . . . -84.41 50.74 1.94 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.617 -175.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 24.0 p90 -174.28 136.94 0.5 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.101 179.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 36.8 m -92.0 -29.12 16.78 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 84.44 -57.39 5.03 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.802 176.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -77.31 147.86 35.98 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.029 0.442 . . . . 0.0 111.627 -175.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 100.2 -0.48 56.0 Favored Glycine 0 N--CA 1.452 -0.236 0 CA-C-N 115.822 -0.626 . . . . 0.0 113.755 173.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -118.65 -44.7 2.63 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.508 0.654 . . . . 0.0 111.583 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 55.3 tttp -108.04 -17.67 13.98 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 71.65 -50.99 0.69 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.775 178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 130.41 130.39 3.2 Favored Glycine 0 N--CA 1.445 -0.756 0 C-N-CA 120.485 -0.864 . . . . 0.0 113.346 174.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 p -105.02 34.82 3.03 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.624 0.726 . . . . 0.0 109.358 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 16.0 p -76.2 -47.41 24.16 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.799 -1.092 . . . . 0.0 112.443 -172.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -87.46 117.18 68.21 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.904 -173.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -70.59 126.82 13.16 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 123.039 2.492 . . . . 0.0 110.986 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 63.86 -78.99 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.292 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 13.5 p -155.84 -26.18 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.921 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.6 tp -82.49 160.46 22.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.624 -178.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 36.3 t -63.7 -49.96 71.09 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 120.841 0.353 . . . . 0.0 110.261 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.266 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.309 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 111.594 -0.602 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.2 m -155.66 121.55 5.05 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.875 0.369 . . . . 0.0 110.859 179.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -96.44 -3.92 42.59 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.0 tttt 64.51 37.54 7.97 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 114.631 -1.168 . . . . 0.0 110.442 176.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 6' ' ' GLN . 15.6 mmm180 -94.69 -176.95 4.04 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.098 178.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' HB3' ' O ' ' A' ' 5' ' ' ARG . 54.0 tt0 73.95 125.89 0.04 OUTLIER 'General case' 0 C--O 1.235 0.303 0 O-C-N 123.794 0.684 . . . . 0.0 110.522 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -78.57 74.34 5.1 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.633 -179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 62' ' ' GLN . 16.3 m -85.88 52.78 2.57 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.84 -172.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 6.1 p -104.99 22.12 15.85 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.695 0.759 . . . . 0.0 110.056 177.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -63.24 -35.05 79.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.977 179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.888 ' HA ' ' HA ' ' A' ' 62' ' ' GLN . 19.9 t70 66.97 126.89 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.983 0.913 . . . . 0.0 112.507 179.686 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.718 HG22 ' O ' ' A' ' 62' ' ' GLN . 9.0 m -122.19 166.94 16.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.281 -178.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -112.98 122.96 49.21 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.02 0.438 . . . . 0.0 110.527 178.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.814 HG11 HD22 ' A' ' 54' ' ' LEU . 98.8 t -101.92 106.51 19.85 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 178.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.861 HG13 ' HE3' ' A' ' 17' ' ' LYS . 9.7 p -71.29 122.25 22.97 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 122.081 0.943 . . . . 0.0 111.962 -172.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 45' ' ' ILE . 4.8 tt -105.13 127.88 53.11 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.484 -1.235 . . . . 0.0 109.265 175.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.901 ' HG2' ' HD3' ' A' ' 77' ' ' LYS . 0.5 OUTLIER -104.36 135.08 46.48 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.627 -177.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.488 HD21 ' HD2' ' A' ' 71' ' ' ARG . 9.1 tp -101.16 105.75 16.92 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.787 -1.097 . . . . 0.0 108.236 -177.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.736 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.9 m95 -101.4 -168.19 1.52 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.73 -175.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -82.3 -35.35 28.06 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.869 177.575 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.47 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 40.7 t -91.41 -43.42 9.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.815 0.341 . . . . 0.0 110.946 -177.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.68 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.29 -151.36 6.16 Favored Glycine 0 N--CA 1.442 -0.904 0 C-N-CA 120.088 -1.053 . . . . 0.0 112.85 -175.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.697 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 49.1 p90 -130.3 147.83 52.06 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 120.835 0.35 . . . . 0.0 110.46 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.577 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 27.7 t -121.01 129.91 53.58 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.544 HD23 ' N ' ' A' ' 25' ' ' LEU . 0.2 OUTLIER -113.59 140.23 48.35 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 -177.173 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.14 86.37 0.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.535 0.683 . . . . 0.0 111.907 -169.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.512 HD21 HD12 ' A' ' 25' ' ' LEU . 9.6 p30 174.04 -28.65 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.234 -1.348 . . . . 0.0 107.725 -176.203 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -148.66 -157.89 7.77 Favored Glycine 0 N--CA 1.449 -0.482 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.741 178.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -102.38 -161.52 0.86 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.736 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -80.45 129.32 34.43 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.239 -178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.583 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 42.3 mtm180 -125.84 128.74 48.11 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.789 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.68 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.8 m -73.72 155.27 39.11 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -168.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.697 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 43.3 m-85 -77.42 41.47 0.32 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.384 -0.826 . . . . 0.0 112.465 -173.427 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -142.08 -38.39 0.38 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.497 0.189 . . . . 0.0 111.467 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.671 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.5 t70 -56.9 130.76 79.09 Favored Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.003 -178.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 42.4 Cg_exo -58.65 -21.84 57.61 Favored 'Trans proline' 0 CA--C 1.532 0.38 0 C-N-CA 123.672 2.915 . . . . 0.0 114.301 -176.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 36.0 m -83.06 -30.28 28.14 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.671 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 31.8 m-20 -74.71 -24.55 58.77 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.938 178.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.92 -29.07 66.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.068 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.513 HE22 ' HB3' ' A' ' 51' ' ' PRO . 0.5 OUTLIER -59.35 -46.32 88.95 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.414 0.626 . . . . 0.0 110.35 176.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.652 ' HE1' ' HB2' ' A' ' 53' ' ' GLU . 63.0 m-85 -66.47 -53.23 37.62 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.841 179.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.423 ' O ' ' HB3' ' A' ' 46' ' ' ARG . 97.9 mt -48.69 -43.33 36.9 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.76 0.663 . . . . 0.0 110.654 179.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.1 mm-40 -59.17 -69.82 0.18 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.859 176.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 53.9 m -56.55 -38.08 71.42 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.861 0.362 . . . . 0.0 111.514 -175.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 16' ' ' LEU . 94.3 mt -70.89 -33.18 51.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.121 -176.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.526 ' HD2' ' HA ' ' A' ' 43' ' ' GLU . 3.7 ptm180 -76.57 -27.8 55.99 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 24.2 mmt180 -78.01 -19.35 54.56 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.542 177.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.64 14.01 53.96 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 121.102 -0.57 . . . . 0.0 111.716 -178.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -97.48 170.67 8.88 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.816 0.341 . . . . 0.0 110.442 -178.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.541 HG11 HG13 ' A' ' 63' ' ' VAL . 58.0 t -99.56 113.66 65.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.937 -178.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.513 ' HB3' HE22 ' A' ' 40' ' ' GLN . 52.4 Cg_exo -55.27 142.84 78.1 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.159 2.572 . . . . 0.0 112.445 175.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.513 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -60.92 -22.61 64.53 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.537 -177.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.652 ' HB2' ' HE1' ' A' ' 41' ' ' PHE . 4.8 tp10 -55.92 -45.18 78.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.605 0.717 . . . . 0.0 110.72 176.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.814 HD22 HG11 ' A' ' 14' ' ' VAL . 2.0 mt -81.79 -27.45 33.71 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.184 -0.917 . . . . 0.0 108.719 -176.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -66.44 -32.2 73.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.534 -1.212 . . . . 0.0 110.103 176.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 23.1 mmm180 -85.46 36.7 0.65 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.115 175.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.4 tt -147.53 -59.92 0.27 Allowed 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.988 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -89.86 142.24 27.88 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.613 177.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 53.2 m-70 -100.2 142.14 32.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.784 -168.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 69.03 -6.45 3.9 Favored Glycine 0 CA--C 1.521 0.418 0 N-CA-C 114.554 0.581 . . . . 0.0 114.554 170.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.409 ' C ' ' H ' ' A' ' 63' ' ' VAL . . . 114.63 9.63 14.14 Favored Glycine 0 CA--C 1.504 -0.636 0 C-N-CA 120.551 -0.833 . . . . 0.0 111.642 -175.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.888 ' HA ' ' HA ' ' A' ' 11' ' ' ASP . 33.9 tt0 -67.02 43.25 0.03 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 C-N-CA 123.857 0.863 . . . . 0.0 109.827 170.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.988 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 7.4 p -153.21 124.17 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-O 121.46 0.648 . . . . 0.0 112.502 -172.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -134.02 161.17 35.56 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 165.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.54 154.55 19.34 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 120.706 -0.398 . . . . 0.0 109.928 -175.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.494 ' HB3' ' HA ' ' A' ' 15' ' ' VAL . 1.4 t70 -122.35 162.97 20.57 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 -178.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 64.6 mtt -125.95 131.37 52.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.132 0.491 . . . . 0.0 111.515 -178.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.4 ' HG2' HE22 ' A' ' 90' ' ' GLN . 18.4 tt0 -138.32 139.44 39.09 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.184 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -102.78 124.96 49.28 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.171 0.51 . . . . 0.0 111.576 -175.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.665 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 88.1 m-70 -147.58 35.63 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.694 175.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HD2' HD21 ' A' ' 18' ' ' LEU . 25.6 mtp180 -60.98 -33.32 73.04 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.372 0.606 . . . . 0.0 110.775 -179.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -81.24 -7.31 59.55 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.628 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.665 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 7.6 mm-40 -103.2 -48.17 4.1 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.7 -178.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 75' ' ' PHE . 16.4 t70 70.89 179.44 0.24 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.863 -169.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.664 ' CE1' ' HD2' ' A' ' 78' ' ' PRO . 13.6 t80 -56.74 136.75 55.13 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.282 0.475 . . . . 0.0 112.282 -162.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -166.46 -14.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.901 ' HD3' ' HG2' ' A' ' 17' ' ' LYS . 23.3 mtpp -83.73 -70.0 0.14 Allowed Pre-proline 0 CA--C 1.542 0.672 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -168.271 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.791 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 17.3 Cg_exo -71.77 47.39 0.94 Allowed 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 122.947 2.431 . . . . 0.0 113.344 175.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.424 ' HE2' ' HB3' ' A' ' 79' ' ' LYS . 32.6 mtpt -115.81 -15.32 11.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.676 0.274 . . . . 0.0 111.517 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 117.71 -52.7 0.68 Allowed Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.966 175.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -62.24 152.22 34.06 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.358 -0.238 . . . . 0.0 110.358 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -113.87 73.81 0.84 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.5 0.667 . . . . 0.0 111.309 -176.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 12.1 ptmm? -120.75 -7.3 9.59 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 170.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.825 ' HB1' ' HG2' ' A' ' 77' ' ' LYS . . . -65.93 115.74 6.33 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.198 -177.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -76.78 174.46 10.46 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.096 178.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 5.3 t -161.28 105.89 1.32 Allowed 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.293 0.568 . . . . 0.0 112.035 -177.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.39 -77.21 1.23 Allowed Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.655 -0.702 . . . . 0.0 113.934 170.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 49.6 mm-40 -76.75 72.94 3.4 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.152 0.501 . . . . 0.0 111.138 -175.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 95.32 103.09 1.9 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.891 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.4 HE22 ' HG2' ' A' ' 68' ' ' GLU . 15.0 mm-40 -92.74 -35.12 13.62 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.969 0.414 . . . . 0.0 110.047 -179.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -168.58 103.69 0.42 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.626 176.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 47.8 tp -114.94 -23.5 9.07 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.577 175.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 169.68 129.02 1.06 Allowed Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.652 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.7 t -102.57 36.44 2.17 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.9 0.381 . . . . 0.0 110.508 -175.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -63.23 -33.04 74.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.089 0.471 . . . . 0.0 110.711 178.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -124.65 96.02 41.66 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.133 172.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -56.14 -56.49 2.08 Favored 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.41 2.74 . . . . 0.0 112.831 -176.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.435 ' HG3' HG12 ' A' ' 99' ' ' VAL . 5.1 tp-100 179.35 -82.3 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.896 0.379 . . . . 0.0 110.233 177.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.435 HG12 ' HG3' ' A' ' 98' ' ' GLN . 8.7 p -163.05 -29.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.273 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 13.5 tp -54.91 -74.98 0.04 OUTLIER 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.139 0.495 . . . . 0.0 110.694 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 14.8 m -94.0 57.44 2.42 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.223 0.535 . . . . 0.0 109.606 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.494 -0.765 . . . . 0.0 110.119 -178.291 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.698 0 N-CA-C 112.484 -0.247 . . . . 0.0 112.484 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 t -120.91 -47.87 2.27 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.963 0.382 . . . . 0.0 109.995 178.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.638 ' HG3' ' H ' ' A' ' 4' ' ' LYS . 3.0 pt-20 -57.24 -46.34 83.09 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 121.325 0.583 . . . . 0.0 109.611 175.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.638 ' H ' ' HG3' ' A' ' 3' ' ' GLU . 36.7 mtmm -118.3 79.83 1.44 Allowed 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.845 172.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 13.5 tpp85 -51.59 -44.73 62.89 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.641 179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.3 tp60 -177.36 -74.17 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.606 -1.179 . . . . 0.0 108.461 173.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 83.9 t60 176.91 134.57 0.06 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.48 -1.236 . . . . 0.0 107.838 176.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.641 ' HB3' ' O ' ' A' ' 59' ' ' HIS . 19.6 m 61.25 73.89 0.46 Allowed 'General case' 0 C--N 1.327 -0.371 0 O-C-N 123.706 0.629 . . . . 0.0 110.823 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.9 p -134.06 -2.49 2.87 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.873 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -96.84 4.18 51.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.8 m-20 49.43 -157.86 0.08 Allowed 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.695 0.622 . . . . 0.0 112.028 173.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.52 ' CG1' ' HA ' ' A' ' 58' ' ' ALA . 10.9 p -162.61 139.18 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-O 121.701 0.763 . . . . 0.0 112.355 175.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -111.88 105.07 13.42 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.052 -0.976 . . . . 0.0 109.384 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.628 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 19.8 m -103.93 136.37 37.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.184 0.516 . . . . 0.0 110.291 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.63 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.5 p -108.35 127.94 64.28 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.294 0.569 . . . . 0.0 111.155 -177.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.458 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.9 tt -104.67 127.87 52.57 Favored 'General case' 0 N--CA 1.435 -1.203 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.272 175.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.667 ' HE3' ' HB2' ' A' ' 77' ' ' LYS . 64.3 mttm -110.22 138.15 46.99 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.033 -179.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.522 ' HG ' ' HG3' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -99.67 121.86 41.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 -178.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.867 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.7 m95 -112.89 175.89 5.25 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.657 -177.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.19 -15.38 60.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.534 -179.098 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.495 ' O ' HD21 ' A' ' 30' ' ' LEU . 18.6 t -147.61 59.82 1.14 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.991 -0.55 . . . . 0.0 109.769 177.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.661 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . 132.46 -174.45 20.37 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.483 -0.865 . . . . 0.0 113.188 174.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.542 ' HZ ' ' HB2' ' A' ' 41' ' ' PHE . 38.4 p90 -140.74 156.33 46.22 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 178.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.502 ' HG ' ' HE1' ' A' ' 19' ' ' TRP . 88.5 p -133.76 160.19 38.33 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 176.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.63 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 1.2 mp -131.38 -179.43 5.35 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 -177.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.454 ' HB3' HG12 ' A' ' 14' ' ' VAL . 24.5 t70 -61.85 -32.86 73.24 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.339 0.59 . . . . 0.0 109.577 176.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.854 ' HB3' HD12 ' A' ' 57' ' ' LEU . 2.4 p-10 -88.26 -33.59 18.02 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.028 -0.987 . . . . 0.0 112.794 -176.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -133.12 160.86 24.05 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.121 -1.038 . . . . 0.0 113.588 -169.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -83.71 -174.99 5.6 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.987 0.422 . . . . 0.0 111.61 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.867 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.1 tt -69.99 118.35 12.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.934 -178.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.416 ' HD3' ' HB3' ' A' ' 38' ' ' ASN . 20.7 mtp180 -120.99 126.25 49.44 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 173.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.661 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 43.3 t -70.97 143.77 50.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.125 0.488 . . . . 0.0 111.659 -170.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -61.21 -9.94 5.78 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.221 -0.9 . . . . 0.0 113.148 -171.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -91.33 -26.16 19.07 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.935 0.398 . . . . 0.0 110.664 -179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.527 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 8.4 t70 -65.03 128.33 93.68 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.369 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 6.1 Cg_exo -79.16 8.67 3.71 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.007 2.472 . . . . 0.0 113.391 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.4 m -95.9 -33.34 12.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.071 0.462 . . . . 0.0 110.421 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.527 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 10.5 p30 -89.66 -14.88 33.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.223 0.535 . . . . 0.0 109.701 173.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.42 ' HB2' ' HA ' ' A' ' 36' ' ' PRO . . . -46.25 -36.91 6.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.772 -1.104 . . . . 0.0 112.275 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.834 ' HG3' ' H ' ' A' ' 41' ' ' PHE . 0.1 OUTLIER -53.06 -60.11 3.7 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.995 0.426 . . . . 0.0 110.994 175.701 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.834 ' H ' ' HG3' ' A' ' 40' ' ' GLN . 95.9 m-85 -43.5 -62.35 1.11 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.453 173.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 58.2 mt -47.31 -49.35 24.22 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.707 -176.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 53.3 tt0 -65.57 -52.23 53.78 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.732 -178.433 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 t -60.07 -43.05 95.75 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.846 -177.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 79.6 mt -73.3 -27.83 24.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-O 121.395 0.617 . . . . 0.0 110.016 -177.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -68.88 -45.18 71.64 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.956 174.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 21.8 mmm180 -64.15 -35.64 81.44 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.438 -0.801 . . . . 0.0 111.725 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.35 9.06 22.44 Favored Glycine 0 N--CA 1.452 -0.272 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -176.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -96.37 166.32 11.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.396 -0.402 . . . . 0.0 110.204 -179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.748 HG11 HH21 ' A' ' 55' ' ' ARG . 12.5 p -101.37 123.13 45.71 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-O 121.383 0.611 . . . . 0.0 112.039 -177.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.54 ' HD2' HD11 ' A' ' 54' ' ' LEU . 36.3 Cg_exo -58.7 136.59 74.86 Favored 'Trans proline' 0 C--O 1.235 0.371 0 C-N-CA 122.585 2.19 . . . . 0.0 111.137 170.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.24 -23.82 66.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.367 -175.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.689 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.5 mp0 -57.3 -44.88 84.5 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.885 178.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.54 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.1 OUTLIER -85.54 -15.93 41.11 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 -177.132 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.748 HH21 HG11 ' A' ' 50' ' ' VAL . 10.5 tpp180 -78.17 -32.92 50.43 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.627 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 24.6 mmt85 -77.89 -3.16 40.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.671 174.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.854 HD12 ' HB3' ' A' ' 27' ' ' ASN . 1.1 tt -104.34 -34.64 8.23 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 172.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.52 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . . . -57.83 120.82 9.12 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 122.406 1.098 . . . . 0.0 111.481 175.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.641 ' O ' ' HB3' ' A' ' 8' ' ' SER . 35.8 m80 -88.4 -70.34 0.65 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.389 -176.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.554 ' HA2' ' O ' ' A' ' 8' ' ' SER . . . -68.45 -32.83 75.85 Favored Glycine 0 N--CA 1.453 -0.206 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.385 -177.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 127.82 -21.46 5.59 Favored Glycine 0 CA--C 1.499 -0.946 0 N-CA-C 111.089 -0.804 . . . . 0.0 111.089 -177.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.444 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 6.2 tt0 -72.51 90.89 1.36 Allowed 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.002 -0.599 . . . . 0.0 109.631 171.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.746 HG11 HG21 ' A' ' 50' ' ' VAL . 3.6 p -94.81 102.67 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.714 0.768 . . . . 0.0 109.259 174.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -106.88 111.75 24.4 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.134 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 0.1 OUTLIER -104.47 139.74 38.95 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.227 0.536 . . . . 0.0 109.967 178.96 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.87 166.58 12.64 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.172 179.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.457 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 75.8 mtp -129.82 136.11 49.19 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.824 0.345 . . . . 0.0 110.865 -177.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 85.6 mt-10 -124.21 140.56 52.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -104.22 96.16 6.45 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.387 -176.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.438 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 68.0 m-70 -106.04 -54.2 2.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.286 0.565 . . . . 0.0 110.357 178.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.535 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 47.4 mtp180 57.26 -98.73 0.09 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 114.94 -1.027 . . . . 0.0 112.62 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -73.69 -2.36 22.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.778 0.323 . . . . 0.0 111.467 -173.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 0.8 OUTLIER -70.2 -20.75 63.09 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.157 0.503 . . . . 0.0 110.481 172.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.0 t0 62.58 176.14 0.14 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.072 -178.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.723 ' HB2' HD12 ' A' ' 30' ' ' LEU . 3.1 t80 -66.9 128.5 36.55 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.525 0.935 . . . . 0.0 113.525 -166.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 75' ' ' PHE . 0.1 OUTLIER -159.84 99.85 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.896 173.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.881 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 17.5 ttpp -162.09 -69.82 0.01 OUTLIER Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 163.039 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.881 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 22.4 Cg_exo -68.89 -38.92 9.06 Favored 'Trans proline' 0 N--CA 1.475 0.437 0 C-N-CA 123.074 2.516 . . . . 0.0 112.534 -175.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.3 mmmt -49.46 -44.31 45.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.369 -1.287 . . . . 0.0 112.308 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -178.92 33.29 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.71 0 N-CA-C 110.981 -0.848 . . . . 0.0 110.981 175.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 61.42 -79.62 0.02 OUTLIER 'General case' 0 C--O 1.235 0.338 0 O-C-N 124.171 0.571 . . . . 0.0 110.439 -172.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.791 ' HD2' ' HG2' ' A' ' 83' ' ' LYS . 16.8 t80 66.9 -70.57 0.11 Allowed 'General case' 0 C--O 1.233 0.188 0 C-N-CA 123.948 0.899 . . . . 0.0 110.682 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.791 ' HG2' ' HD2' ' A' ' 82' ' ' PHE . 21.2 pttp -159.03 65.41 0.41 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.487 177.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.83 -36.09 67.1 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.981 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -146.3 129.99 17.04 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 170.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 3.6 t -130.07 -49.27 1.11 Allowed 'General case' 0 C--N 1.319 -0.725 0 C-N-CA 120.739 -0.384 . . . . 0.0 111.644 -174.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 75.8 -49.0 2.39 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.094 -0.574 . . . . 0.0 112.58 -178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -53.68 -51.2 63.97 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 123.051 0.54 . . . . 0.0 110.898 -177.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -102.89 28.64 14.96 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.473 179.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -126.15 -66.43 0.93 Allowed 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.312 0.577 . . . . 0.0 109.851 179.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.435 ' HD2' HG21 ' A' ' 102' ' ' THR . 25.2 ttpp -161.51 90.34 0.79 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.266 -0.879 . . . . 0.0 108.68 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 92' ' ' LEU . 1.9 tm? -66.64 -39.65 88.34 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 -179.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -139.69 -83.23 0.09 OUTLIER Glycine 0 N--CA 1.443 -0.835 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.111 178.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 31.4 p -151.21 -62.17 0.18 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 120.64 0.257 . . . . 0.0 110.584 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m 60.18 55.65 3.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.997 0.903 . . . . 0.0 109.496 -174.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' HB1' ' HA ' ' A' ' 101' ' ' SER . . . -141.07 71.87 27.87 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.674 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -64.6 -67.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.801 2.334 . . . . 0.0 112.824 -174.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -151.33 149.92 29.91 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -179.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 61.3 t 70.4 -58.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 O-C-N 123.985 0.803 . . . . 0.0 110.529 -176.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.426 ' N ' HD12 ' A' ' 100' ' ' LEU . 5.5 mp -79.58 116.72 19.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 174.223 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.475 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . 36.6 t -126.32 126.62 44.24 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.036 -178.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.435 HG21 ' HD2' ' A' ' 91' ' ' LYS . 23.5 m . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.188 178.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.77 0 N-CA-C 112.383 -0.287 . . . . 0.0 112.383 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 28.9 t -177.72 -69.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.152 0.501 . . . . 0.0 109.687 178.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -137.11 -27.29 0.98 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.27 177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -78.23 84.51 4.43 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 171.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.403 ' HD2' ' HA ' ' A' ' 5' ' ' ARG . 19.9 mmm180 -95.51 -175.83 3.58 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.098 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 62.64 -171.44 0.16 Allowed 'General case' 0 C--O 1.234 0.241 0 O-C-N 123.797 0.686 . . . . 0.0 111.236 -177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -140.49 142.1 35.31 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 173.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.432 ' HB3' HG11 ' A' ' 12' ' ' VAL . 3.1 t -51.63 120.06 4.81 Favored 'General case' 0 C--N 1.329 -0.312 0 O-C-N 123.572 0.545 . . . . 0.0 109.893 -177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.537 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 66.7 m -134.72 46.8 2.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.843 -171.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -143.81 52.3 1.32 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 63.77 105.01 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.395 0 O-C-N 123.734 0.646 . . . . 0.0 109.862 -176.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.519 HG22 ' HB2' ' A' ' 58' ' ' ALA . 2.1 m -118.59 165.58 13.77 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 113.79 1.033 . . . . 0.0 113.79 -161.375 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -114.17 116.66 29.44 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.201 -1.363 . . . . 0.0 109.732 175.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.559 ' O ' ' HA ' ' A' ' 65' ' ' LEU . 47.2 t -104.85 151.45 7.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 178.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.933 HG13 ' HE3' ' A' ' 17' ' ' LYS . 10.3 p -130.23 140.23 49.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.87 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.296 -177.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.629 HD21 ' CD2' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -103.15 116.73 33.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.933 ' HE3' HG13 ' A' ' 15' ' ' VAL . 16.8 mttt -104.41 129.65 52.34 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.596 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 60.4 mt -100.19 140.37 34.52 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -176.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.959 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 12.4 m95 -133.66 -174.0 3.39 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.903 0.382 . . . . 0.0 110.185 -178.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.433 ' H ' ' HG3' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -77.97 -25.79 48.37 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.808 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.417 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 17.9 m -94.86 -44.73 7.61 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.277 0.56 . . . . 0.0 110.579 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -165.92 -142.73 3.51 Favored Glycine 0 N--CA 1.44 -1.047 0 C-N-CA 120.797 -0.716 . . . . 0.0 111.883 -176.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.629 ' CD2' HD21 ' A' ' 16' ' ' LEU . 29.3 p90 -135.24 147.37 49.28 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.034 0.445 . . . . 0.0 110.843 -176.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.6 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 45.4 t -118.25 148.17 42.69 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 175.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 25' ' ' LEU . 1.8 mm? -103.77 -169.06 1.58 Allowed 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 177.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.436 ' HB2' ' H ' ' A' ' 15' ' ' VAL . 1.9 t70 -91.7 -5.34 53.88 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.125 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.639 ' HB3' ' HG ' ' A' ' 57' ' ' LEU . 1.4 p-10 -102.49 -36.06 8.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 114.276 -1.329 . . . . 0.0 111.225 177.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -127.52 162.65 21.45 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.162 -174.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -80.85 -171.95 3.43 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 120.724 0.297 . . . . 0.0 111.586 -175.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.959 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.5 OUTLIER -62.71 114.97 3.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.05 177.724 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.663 ' HB3' ' CG ' ' A' ' 38' ' ' ASN . 84.4 mtt180 -115.1 111.65 21.39 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.81 -1.086 . . . . 0.0 109.798 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.605 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 24.9 t -54.8 139.74 38.73 Favored 'General case' 0 C--N 1.33 -0.267 0 O-C-N 123.454 0.471 . . . . 0.0 111.554 -179.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -61.44 -17.95 56.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.148 -172.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -79.35 -32.33 43.22 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -173.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.787 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.1 t70 -63.87 131.96 95.09 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 121.112 0.482 . . . . 0.0 111.524 -175.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 48.3 Cg_exo -57.72 -26.9 75.35 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 123.883 3.055 . . . . 0.0 114.434 -174.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 29.3 t -79.66 -27.06 40.89 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 122.044 0.926 . . . . 0.0 109.066 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.787 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 25.6 m-20 -81.65 -25.53 35.51 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.48 -1.237 . . . . 0.0 110.031 -179.44 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.1 -30.28 70.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.227 172.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.524 ' HB3' ' O ' ' A' ' 37' ' ' SER . 0.9 OUTLIER -56.42 -50.4 71.75 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.712 -0.676 . . . . 0.0 109.974 175.594 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.627 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 94.8 m-85 -60.83 -60.1 4.34 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.959 177.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.3 mt -48.67 -44.36 37.69 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.728 -175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.695 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 45.0 tt0 -62.46 -61.94 2.1 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.575 178.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.5 m -57.9 -38.82 76.54 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.638 0.256 . . . . 0.0 111.434 -177.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 93.5 mt -67.79 -31.87 54.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.461 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.424 -178.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 12.9 ptm180 -85.31 -28.87 24.98 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.156 -0.34 . . . . 0.0 111.432 177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.695 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 8.5 mmm180 -76.45 -27.35 56.14 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.676 0.274 . . . . 0.0 111.253 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 106.22 14.08 21.36 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.689 -177.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -92.69 -174.34 3.61 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.82 0.343 . . . . 0.0 110.237 -179.017 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 86.9 t -122.39 111.0 31.99 Favored Pre-proline 0 C--N 1.324 -0.52 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.55 179.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.532 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 52.6 Cg_exo -55.23 137.23 76.43 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.977 2.451 . . . . 0.0 112.334 176.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -59.88 -32.02 70.33 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.746 -175.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.627 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 7.8 mm-40 -61.1 -33.46 73.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.661 -0.245 . . . . 0.0 111.63 179.358 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.532 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 0.3 OUTLIER -85.36 -39.44 17.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.396 0.617 . . . . 0.0 109.644 179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -64.65 -42.06 95.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.346 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 56' ' ' ARG . 8.6 mmt180 -86.36 26.37 1.07 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.521 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.639 ' HG ' ' HB3' ' A' ' 27' ' ' ASN . 2.9 tm? -124.81 -43.74 1.98 Allowed 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 174.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.519 ' HB2' HG22 ' A' ' 12' ' ' VAL . . . -79.09 136.26 37.1 Favored 'General case' 0 CA--C 1.51 -0.575 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.045 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.537 ' HB3' ' HA ' ' A' ' 9' ' ' SER . 2.1 t60 -107.71 138.78 43.33 Favored 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.888 -1.051 . . . . 0.0 108.502 173.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 107.1 -32.17 7.47 Favored Glycine 0 N--CA 1.445 -0.756 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -174.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 107.24 -24.66 24.06 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.781 176.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -75.1 95.43 3.07 Favored 'General case' 0 N--CA 1.445 -0.725 0 CA-C-O 121.333 0.587 . . . . 0.0 109.888 178.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.6 p -116.51 105.15 17.78 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.923 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.273 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -102.62 118.35 36.66 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.999 -177.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.559 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 22.5 tp -102.74 125.18 49.38 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.217 0.532 . . . . 0.0 110.997 -175.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -103.8 166.38 10.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.927 177.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 84.3 mtp -129.38 123.52 31.91 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.094 0.474 . . . . 0.0 112.069 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -112.83 161.68 16.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.513 -0.767 . . . . 0.0 109.827 175.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.596 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 9.2 t0 -130.81 120.64 24.02 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.018 0.437 . . . . 0.0 110.164 174.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.477 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 72.2 m-70 -140.12 38.51 1.94 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 176.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.488 ' HA ' ' HA ' ' A' ' 19' ' ' TRP . 77.6 mtp180 -75.39 62.32 1.32 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.332 -173.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -179.3 -39.85 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.353 -177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.553 ' OE2' ' HA ' ' A' ' 84' ' ' ALA . 17.0 mt-10 -63.86 -42.92 97.44 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 114.519 -1.218 . . . . 0.0 111.619 175.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 77.59 164.86 0.23 Allowed 'General case' 0 N--CA 1.47 0.55 0 O-C-N 124.446 1.091 . . . . 0.0 111.092 -174.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.859 ' HB2' HD12 ' A' ' 30' ' ' LEU . 28.3 t80 -50.98 126.13 15.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.089 -0.96 . . . . 0.0 113.14 -167.014 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.505 ' HA ' ' HD2' ' A' ' 79' ' ' LYS . 4.5 p -160.77 -21.95 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 115.98 -0.554 . . . . 0.0 112.274 -175.709 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.709 ' HB2' ' HD3' ' A' ' 78' ' ' PRO . 6.4 mmmt -62.19 -65.17 2.31 Favored Pre-proline 0 CA--C 1.544 0.744 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 -170.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.709 ' HD3' ' HB2' ' A' ' 77' ' ' LYS . 72.9 Cg_exo -56.48 -36.08 97.25 Favored 'Trans proline' 0 N--CA 1.479 0.621 0 C-N-CA 123.269 2.646 . . . . 0.0 113.299 178.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.549 ' HE3' ' CD2' ' A' ' 75' ' ' PHE . 95.1 mttt -48.93 -59.16 3.83 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.539 178.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 141.06 -156.68 25.67 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.31 -43.52 0.55 Allowed 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.494 0.718 . . . . 0.0 111.914 178.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 57.56 58.13 3.94 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 111.691 175.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -104.07 -7.17 20.46 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.374 172.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.553 ' HA ' ' OE2' ' A' ' 73' ' ' GLU . . . -56.81 128.18 35.37 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.929 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -87.46 82.17 7.59 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.252 0.549 . . . . 0.0 110.611 -174.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.3 m -80.03 82.74 6.05 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.066 176.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -155.61 178.66 32.09 Favored Glycine 0 N--CA 1.445 -0.767 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.438 -179.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -86.65 -39.83 15.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.302 0.573 . . . . 0.0 110.031 -179.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.462 ' HA2' HD11 ' A' ' 92' ' ' LEU . . . -80.44 44.58 2.92 Favored Glycine 0 C--O 1.227 -0.292 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.847 -177.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -90.8 136.09 33.3 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt 74.99 -42.21 0.48 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 111.699 179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.462 HD11 ' HA2' ' A' ' 89' ' ' GLY . 4.5 pp -75.63 -14.36 60.37 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 171.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -136.59 132.78 6.2 Favored Glycine 0 N--CA 1.438 -1.209 0 CA-C-N 114.539 -1.21 . . . . 0.0 110.123 172.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 39.4 p -164.16 -37.41 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.995 0.398 . . . . 0.0 111.153 -176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.2 p -67.84 -20.79 65.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.501 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -122.48 81.27 46.73 Favored Pre-proline 0 C--N 1.326 -0.424 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.033 174.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.439 ' HB2' ' HA ' ' A' ' 102' ' ' THR . 46.1 Cg_exo -57.13 111.25 0.75 Allowed 'Trans proline' 0 C--O 1.239 0.536 0 C-N-CA 123.334 2.689 . . . . 0.0 112.574 -176.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 33.9 tt0 58.63 24.45 12.09 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.465 178.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 35.9 m 40.23 36.08 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 124.197 0.999 . . . . 0.0 112.562 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 40.1 mt -125.89 -70.32 0.74 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.631 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.9 p -152.45 -77.8 0.12 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.407 178.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.439 ' HA ' ' HB2' ' A' ' 97' ' ' PRO . 1.2 p . . . . . 0 C--O 1.25 1.091 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.341 179.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.732 0 N-CA-C 111.859 -0.497 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.3 m -74.31 124.63 26.83 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.863 0.363 . . . . 0.0 110.331 178.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.85 -3.68 45.05 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.182 0.515 . . . . 0.0 110.281 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.7 mmtt -83.11 64.93 7.93 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.662 ' HA ' ' HE ' ' A' ' 5' ' ' ARG . 1.8 mmp_? -114.98 168.29 10.04 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.928 -174.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.659 ' HG3' ' H ' ' A' ' 8' ' ' SER . 8.4 tp-100 -78.98 127.93 32.62 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.615 ' O ' ' HB3' ' A' ' 59' ' ' HIS . 65.4 m80 -87.01 9.8 18.44 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.06 -175.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.659 ' H ' ' HG3' ' A' ' 6' ' ' GLN . 16.5 m 60.24 49.03 7.54 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.589 0.709 . . . . 0.0 109.63 -174.031 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.44 ' HA ' ' CD2' ' A' ' 59' ' ' HIS . 28.7 m -84.71 52.0 2.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.223 -175.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -118.24 44.32 2.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.676 -178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.478 ' CB ' ' HB3' ' A' ' 62' ' ' GLN . 1.3 p30 53.64 -177.54 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.849 0 O-C-N 124.531 1.144 . . . . 0.0 112.559 175.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 8.7 p -160.83 117.15 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.332 168.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -107.07 121.96 45.51 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.264 179.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.504 HG13 ' H ' ' A' ' 26' ' ' ASP . 64.5 t -103.75 116.65 47.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.846 -174.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.435 HG11 ' HG2' ' A' ' 78' ' ' PRO . 5.5 p -81.75 110.9 17.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.841 175.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.667 ' HA ' ' O ' ' A' ' 24' ' ' SER . 7.0 tt -118.28 122.03 41.9 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-O 121.541 0.686 . . . . 0.0 110.616 -178.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.481 ' CE ' ' HD3' ' A' ' 78' ' ' PRO . 56.2 mttm -110.13 140.89 43.73 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.638 179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.56 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 2.4 tp -100.02 112.84 25.12 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -176.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.837 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 35.1 m95 -101.42 -168.91 1.62 Allowed 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.683 -175.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -85.53 -28.69 24.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.108 0.48 . . . . 0.0 110.742 176.174 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 8.5 p -96.86 -42.28 8.03 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.375 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -160.9 -149.2 5.52 Favored Glycine 0 N--CA 1.442 -0.938 0 C-N-CA 120.475 -0.869 . . . . 0.0 112.468 -177.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.535 ' HB2' HD21 ' A' ' 16' ' ' LEU . 23.0 p90 -137.72 148.35 45.56 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -178.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.667 ' O ' ' HA ' ' A' ' 16' ' ' LEU . 89.1 p -121.81 143.01 49.65 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.072 177.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.688 HD22 HD21 ' A' ' 27' ' ' ASN . 0.5 OUTLIER -119.19 -172.87 2.39 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.756 -176.181 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' H ' HG13 ' A' ' 14' ' ' VAL . 23.6 t70 -76.09 -43.51 43.14 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.037 175.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.688 HD21 HD22 ' A' ' 25' ' ' LEU . 7.9 p30 -58.88 -36.34 74.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.053 -178.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.77 -156.03 6.71 Favored Glycine 0 N--CA 1.449 -0.485 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.124 -177.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.41 ' OE2' ' HG3' ' A' ' 79' ' ' LYS . 48.3 mt-10 -118.46 -161.77 0.86 Allowed 'General case' 0 C--N 1.322 -0.606 0 O-C-N 122.763 -0.257 . . . . 0.0 110.796 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.837 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.6 tt -64.24 117.47 7.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 121.266 0.555 . . . . 0.0 110.663 -176.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.528 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 64.9 mtt180 -116.66 126.04 52.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.137 173.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.559 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 0.9 OUTLIER -68.13 152.83 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.97 0.414 . . . . 0.0 111.816 -172.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.404 ' HD1' HD11 ' A' ' 42' ' ' LEU . 40.4 m-85 -76.23 51.78 0.71 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 112.273 0.472 . . . . 0.0 112.273 -175.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -144.92 -44.84 0.23 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.648 179.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.68 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 15.5 t70 -57.21 138.47 80.31 Favored Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.995 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 53.1 Cg_exo -55.07 -25.06 43.35 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 124.14 3.226 . . . . 0.0 114.589 -177.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 46.0 t -76.99 -32.51 57.27 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.017 0.913 . . . . 0.0 109.107 179.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.68 ' ND2' ' HB3' ' A' ' 35' ' ' ASP . 4.8 m-20 -81.26 -31.54 33.69 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.061 -174.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -59.79 -30.32 68.81 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.679 176.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.11 -51.95 66.93 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.35 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HA ' ' A' ' 38' ' ' ASN . 77.2 m-85 -56.53 -60.63 3.25 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD11 ' HD1' ' A' ' 33' ' ' TYR . 2.4 mp -42.63 -61.05 1.33 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.292 -1.322 . . . . 0.0 112.839 -175.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 31.8 tt0 -64.3 -40.21 95.47 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.749 -176.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.7 m -65.18 -43.34 91.99 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.04 0.448 . . . . 0.0 109.916 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.466 HG13 ' O ' ' A' ' 41' ' ' PHE . 68.9 mt -71.98 -23.74 22.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.559 0.695 . . . . 0.0 109.513 -178.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.4 ' HB3' ' O ' ' A' ' 43' ' ' GLU . 76.7 ttt180 -68.09 -48.16 66.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.333 174.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -68.72 -25.45 64.76 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.325 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 105.79 8.68 34.15 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.772 -178.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -86.77 168.44 13.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.073 0.463 . . . . 0.0 110.97 -178.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 58.0 t -96.74 125.21 47.58 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.657 -178.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.486 ' HD2' HD11 ' A' ' 54' ' ' LEU . 31.5 Cg_exo -60.67 140.79 92.81 Favored 'Trans proline' 0 C--O 1.237 0.459 0 C-N-CA 122.732 2.288 . . . . 0.0 111.754 175.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.73 -21.51 62.54 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.662 -171.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.452 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 12.7 mp0 -59.51 -38.82 81.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.215 0.531 . . . . 0.0 110.684 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.486 HD11 ' HD2' ' A' ' 51' ' ' PRO . 0.0 OUTLIER -88.7 -34.32 17.23 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.637 -176.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.653 ' HD2' ' O ' ' A' ' 55' ' ' ARG . 4.6 tmm_? -72.5 -28.38 62.85 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.076 -0.966 . . . . 0.0 109.782 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.636 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 3.1 mmp_? -87.24 38.16 0.8 Allowed 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.789 0.328 . . . . 0.0 111.279 168.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.402 HD22 ' HA ' ' A' ' 57' ' ' LEU . 2.5 tm? -133.28 -58.86 0.89 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 171.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -82.18 159.79 23.21 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 168.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.615 ' HB3' ' O ' ' A' ' 7' ' ' HIS . 1.7 p80 -71.77 34.46 0.06 Allowed 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 -177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.415 ' HA2' ' HG2' ' A' ' 55' ' ' ARG . . . 74.68 16.14 80.36 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 111.073 -0.811 . . . . 0.0 111.073 -172.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -117.07 156.03 15.84 Favored Glycine 0 N--CA 1.444 -0.789 0 CA-C-O 119.459 -0.634 . . . . 0.0 111.577 -179.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.478 ' HB3' ' CB ' ' A' ' 11' ' ' ASP . 8.5 tt0 14.1 58.36 0.01 OUTLIER 'General case' 0 C--O 1.232 0.166 0 C-N-CA 125.264 1.426 . . . . 0.0 112.87 -166.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 2.4 p -99.02 104.51 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.334 -179.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -140.68 164.43 30.22 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 121.168 0.509 . . . . 0.0 111.858 -174.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.59 162.4 29.41 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.715 177.059 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.55 146.26 50.58 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 172.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 85.5 mtp -112.11 122.91 49.07 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.149 0.5 . . . . 0.0 111.644 -174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 53.1 mt-10 -108.45 161.06 15.39 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.016 175.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -112.16 121.12 44.05 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 173.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.591 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 91.7 m-70 -144.76 40.46 1.28 Allowed 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 175.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 76.5 mtp180 -63.56 -52.36 61.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.966 -176.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -82.24 16.48 1.99 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 122.108 0.956 . . . . 0.0 109.599 -179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.591 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 2.2 mm-40 -109.76 -28.16 8.95 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.931 -1.031 . . . . 0.0 111.027 -177.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 t70 63.82 177.88 0.17 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.439 -172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.697 ' HB2' HD12 ' A' ' 30' ' ' LEU . 17.7 t80 -63.65 116.06 5.32 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.501 0.667 . . . . 0.0 112.692 -168.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.8 m -150.41 54.94 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 114.39 -1.277 . . . . 0.0 109.624 173.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.94 ' HE3' ' HD2' ' A' ' 78' ' ' PRO . 9.3 ptmt -74.02 177.78 1.95 Allowed Pre-proline 0 C--N 1.328 -0.363 0 N-CA-C 109.806 -0.442 . . . . 0.0 109.806 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.94 ' HD2' ' HE3' ' A' ' 77' ' ' LYS . 30.6 Cg_exo -66.06 52.28 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.172 2.581 . . . . 0.0 112.907 174.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.57 ' HG2' ' CD ' ' A' ' 77' ' ' LYS . 16.3 mmtp -120.14 -64.5 1.25 Allowed 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 122.886 0.474 . . . . 0.0 110.393 174.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -104.16 38.53 3.21 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.392 -177.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -161.64 -50.76 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.407 -0.396 . . . . 0.0 109.997 -175.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 53.52 53.16 12.01 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 123.584 0.552 . . . . 0.0 110.821 -178.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.493 ' NZ ' ' HB3' ' A' ' 83' ' ' LYS . 0.1 OUTLIER -161.52 127.46 3.73 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.85 178.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -114.44 61.84 0.67 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.403 175.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 31.6 p90 -72.45 -23.09 61.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.309 -176.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 12.9 m -106.1 90.43 3.37 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 174.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.46 ' O ' ' HG3' ' A' ' 90' ' ' GLN . . . -99.3 -147.55 21.91 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.753 -174.582 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -49.26 129.22 18.04 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 122.913 0.485 . . . . 0.0 112.269 -176.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 105.94 38.37 2.35 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.677 -179.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 87' ' ' GLY . 8.0 mt-30 -86.44 95.75 9.8 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.21 0.528 . . . . 0.0 111.295 -177.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.477 ' HB3' ' NZ ' ' A' ' 91' ' ' LYS . 8.8 mtpm? 60.53 30.6 19.88 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.033 -0.985 . . . . 0.0 112.126 177.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 54.6 tp -95.42 81.73 3.61 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 151.97 -173.67 31.14 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.999 -0.62 . . . . 0.0 111.898 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 68.6 m 67.45 5.97 4.64 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 123.239 0.615 . . . . 0.0 112.397 179.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 39.4 m 60.4 95.98 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.726 179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -121.65 85.69 44.24 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.489 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo -69.34 -64.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 122.777 2.318 . . . . 0.0 111.859 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -137.3 117.76 13.78 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.015 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.69 78.04 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.383 1.087 . . . . 0.0 110.298 -179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 4.1 tt -162.77 -63.92 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.483 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 4.6 m -78.61 -57.07 3.95 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.796 176.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.661 -179.779 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.671 -0.572 . . . . 0.0 111.671 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 5' ' ' ARG . 19.4 m -97.85 7.31 46.59 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.851 0.358 . . . . 0.0 110.385 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 70.54 -76.42 0.06 Allowed 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.584 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 53.9 mttp -96.78 33.02 1.94 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.48 0.181 . . . . 0.0 111.062 -176.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.562 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 42.0 ttm180 -61.82 -57.73 10.72 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.855 0.359 . . . . 0.0 111.124 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -91.56 118.95 31.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.311 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.4 p80 -147.72 -171.37 3.79 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.055 -179.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 1.036 ' HA ' ' HA ' ' A' ' 58' ' ' ALA . 36.4 m 73.68 -57.19 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 123.816 0.698 . . . . 0.0 111.62 176.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.0 p -111.48 -7.19 14.35 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.999 0.428 . . . . 0.0 110.744 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.46 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 29.1 mt-30 -133.38 56.81 1.83 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.444 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 62' ' ' GLN . 4.4 t70 75.78 151.58 0.12 Allowed 'General case' 0 N--CA 1.469 0.485 0 O-C-N 124.111 0.882 . . . . 0.0 111.997 174.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.551 HG21 HD12 ' A' ' 57' ' ' LEU . 14.7 p -153.77 122.5 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.029 171.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 39.4 m170 -104.53 114.95 29.51 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 171.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.73 HG11 HD22 ' A' ' 54' ' ' LEU . 61.0 t -101.45 125.6 55.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.097 0.475 . . . . 0.0 110.741 -172.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.635 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 7.2 p -73.61 126.6 34.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.295 -179.219 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' HA ' ' O ' ' A' ' 24' ' ' SER . 8.0 tt -135.26 115.04 12.87 Favored 'General case' 0 N--CA 1.437 -1.116 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.451 172.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.6 mttm -104.94 142.29 35.04 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.937 -177.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.61 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.2 OUTLIER -100.88 125.38 47.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 -175.478 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.873 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 18.6 m95 -117.22 -174.02 2.52 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.384 -177.005 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -76.17 -27.36 56.91 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.905 0.383 . . . . 0.0 111.806 179.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 p -101.62 -44.93 5.42 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.917 0.389 . . . . 0.0 111.049 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.556 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -159.73 -147.32 4.85 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.389 -0.91 . . . . 0.0 112.527 -178.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' HD2' ' CE1' ' A' ' 33' ' ' TYR . 46.6 p90 -133.68 151.54 51.67 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.714 0.292 . . . . 0.0 110.264 -178.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.807 ' HB2' ' HD2' ' A' ' 77' ' ' LYS . 88.1 p -123.25 152.59 41.17 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.139 0.495 . . . . 0.0 109.881 174.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.635 ' HA ' ' O ' ' A' ' 15' ' ' VAL . 0.3 OUTLIER -150.09 172.97 14.42 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.179 -167.949 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -62.8 -24.42 67.73 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.721 0.772 . . . . 0.0 109.962 -179.167 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.568 HD22 HD12 ' A' ' 25' ' ' LEU . 2.1 m-80 -81.33 -17.24 49.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.849 -174.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -178.92 165.72 34.89 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.635 -176.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HA ' ' HD2' ' A' ' 77' ' ' LYS . 47.2 mt-10 -75.8 -163.26 0.26 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.726 0.298 . . . . 0.0 111.653 -178.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.873 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 4.7 tt -63.04 111.2 2.08 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.409 0.623 . . . . 0.0 110.582 -175.203 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.726 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 38.7 mtt180 -111.47 117.53 33.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.247 -0.888 . . . . 0.0 110.53 178.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 29.2 t -56.38 146.88 22.88 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 112.673 0.619 . . . . 0.0 112.673 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.615 ' CE1' ' HD2' ' A' ' 23' ' ' PHE . 46.5 m-85 -72.23 -11.24 60.64 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.538 -178.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.2 mm-40 -76.88 -28.89 55.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.128 0.49 . . . . 0.0 110.668 -178.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.669 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 12.3 t70 -70.38 131.48 88.35 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.421 -176.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.71 -10.81 21.9 Favored 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 123.191 2.594 . . . . 0.0 113.981 -175.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.1 m -84.91 -28.75 25.72 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 177.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.726 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 30.6 m-20 -80.84 -21.42 40.78 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.364 -1.289 . . . . 0.0 109.508 177.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -57.78 -30.05 65.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.579 172.594 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.36 -53.0 57.46 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.241 174.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.545 ' O ' HG13 ' A' ' 45' ' ' ILE . 86.3 m-85 -59.43 -60.02 4.52 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.718 -0.674 . . . . 0.0 109.643 176.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' A' ' 46' ' ' ARG . 97.8 mt -45.13 -56.22 4.95 Favored 'General case' 0 C--N 1.329 -0.304 0 O-C-N 124.011 0.82 . . . . 0.0 111.842 -175.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.741 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 5.9 mm-40 -67.26 -49.22 65.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.502 -175.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.2 t -59.89 -40.14 87.74 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.037 0.446 . . . . 0.0 110.154 -179.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.545 HG13 ' O ' ' A' ' 41' ' ' PHE . 69.5 mt -67.67 -40.12 83.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.135 179.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.468 ' HG3' ' O ' ' A' ' 42' ' ' LEU . 95.8 mtt180 -63.22 -42.01 99.21 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.095 176.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.741 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 25.1 mmt180 -64.4 -17.52 63.84 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.387 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 88.75 13.45 62.73 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.182 -0.767 . . . . 0.0 111.182 -175.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.535 ' HG3' ' HB2' ' A' ' 47' ' ' ARG . 57.1 mt-10 -85.9 173.66 9.82 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.057 0.456 . . . . 0.0 109.948 -179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.7 116.33 65.77 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.155 170.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.637 ' HD2' HD12 ' A' ' 54' ' ' LEU . 34.8 Cg_exo -60.94 133.85 49.91 Favored 'Trans proline' 0 C--O 1.237 0.441 0 C-N-CA 122.348 2.032 . . . . 0.0 111.714 178.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.532 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -44.93 -46.79 11.19 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 123.782 0.676 . . . . 0.0 112.174 -171.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -54.94 -35.19 63.96 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 123.745 0.653 . . . . 0.0 112.758 -174.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.73 HD22 HG11 ' A' ' 14' ' ' VAL . 3.8 mt -80.62 -34.22 35.2 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 -175.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.728 ' HD3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -76.76 -15.05 59.87 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.311 175.4 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.532 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 28.4 mmm180 -85.03 1.48 47.45 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 109.933 168.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.551 HD12 HG21 ' A' ' 12' ' ' VAL . 1.3 tm? -102.83 -57.87 1.97 Allowed 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 173.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 1.036 ' HA ' ' HA ' ' A' ' 8' ' ' SER . . . -96.55 132.85 41.73 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.284 -0.416 . . . . 0.0 109.977 173.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.58 70.33 3.1 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.676 -170.51 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 60.84 43.84 98.76 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.91 179.564 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -114.21 -147.99 9.69 Favored Glycine 0 N--CA 1.437 -1.254 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 11' ' ' ASP . 8.8 tt0 -71.02 77.59 0.66 Allowed 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 121.494 0.664 . . . . 0.0 109.511 170.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.919 HG22 ' HB3' ' A' ' 58' ' ' ALA . 13.8 t -95.94 103.98 15.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 CA-C-N 115.408 -0.814 . . . . 0.0 109.791 -177.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -128.25 160.16 33.0 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 120.885 0.374 . . . . 0.0 110.817 -178.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -131.99 155.71 47.5 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 -124.96 136.53 53.83 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 176.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.512 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 90.1 mtp -107.63 125.14 50.97 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.915 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.61 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 58.6 mt-10 -104.7 149.63 25.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.189 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -105.36 119.01 38.02 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.572 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 84.4 m-70 -130.12 -54.3 1.12 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.831 0.348 . . . . 0.0 110.206 177.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.579 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 39.4 mtp180 54.79 -93.7 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.329 -0.851 . . . . 0.0 113.239 174.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -74.77 -5.41 43.21 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.004 0.43 . . . . 0.0 111.318 -177.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.572 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 5.5 mt-10 -67.99 -26.01 65.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.929 169.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 65.75 179.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.456 -1.247 . . . . 0.0 111.198 -178.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.738 ' HB2' HD12 ' A' ' 30' ' ' LEU . 66.4 t80 -61.89 112.92 2.5 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -169.044 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.402 ' O ' HG23 ' A' ' 76' ' ' VAL . 4.5 m -141.51 77.55 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 114.379 -1.282 . . . . 0.0 109.509 173.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.807 ' HD2' ' HB2' ' A' ' 24' ' ' SER . 9.6 mtpt -77.14 166.93 40.81 Favored Pre-proline 0 C--N 1.315 -0.914 0 O-C-N 121.968 -0.458 . . . . 0.0 111.644 -175.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.553 ' HB3' ' O ' ' A' ' 83' ' ' LYS . 38.7 Cg_exo -63.98 -11.98 29.88 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.386 2.724 . . . . 0.0 111.953 179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.68 ' HG2' ' HB3' ' A' ' 77' ' ' LYS . 12.1 ptmm? -86.53 5.13 36.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.768 179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -148.35 35.22 1.15 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.294 179.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -153.37 -85.31 0.07 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.477 0.18 . . . . 0.0 111.18 178.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 81.4 t80 -178.93 137.75 0.14 Allowed 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.553 ' O ' ' HB3' ' A' ' 78' ' ' PRO . 29.5 mmtp 42.22 -93.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -175.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 171.02 -36.9 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 113.998 -1.455 . . . . 0.0 107.104 -174.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -74.07 143.86 45.27 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 114.049 -1.432 . . . . 0.0 110.895 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 21.4 m -61.28 106.19 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.454 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -93.5 86.06 1.12 Allowed Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.428 -0.669 . . . . 0.0 111.428 176.828 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 73.17 -50.14 0.7 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.579 0.752 . . . . 0.0 110.556 -175.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -137.8 168.44 24.51 Favored Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 175.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 18.3 mm-40 -74.56 -76.8 0.13 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 117.091 0.446 . . . . 0.0 109.991 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.47 ' H ' HD22 ' A' ' 92' ' ' LEU . 59.4 tttm -160.21 51.93 0.31 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.823 0.821 . . . . 0.0 109.367 171.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.47 HD22 ' H ' ' A' ' 91' ' ' LYS . 3.1 mm? -99.37 -0.91 40.06 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.004 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -126.94 115.85 2.31 Favored Glycine 0 N--CA 1.44 -1.078 0 C-N-CA 120.864 -0.684 . . . . 0.0 112.225 -178.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 9.8 p -86.13 43.71 1.08 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.334 0.588 . . . . 0.0 110.768 178.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.1 m -86.14 61.89 7.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.884 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 52.69 78.93 0.37 Allowed Pre-proline 0 C--O 1.236 0.364 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.159 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 98' ' ' GLN . 4.6 Cg_exo -74.39 117.8 5.11 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.918 2.412 . . . . 0.0 111.717 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 97' ' ' PRO . 24.0 mt-30 67.96 -172.01 0.19 Allowed 'General case' 0 N--CA 1.465 0.283 0 O-C-N 123.583 0.552 . . . . 0.0 110.548 -178.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 9.8 p -113.76 15.75 8.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.903 0.859 . . . . 0.0 109.861 176.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 98' ' ' GLN . 9.4 mp -82.69 117.58 22.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.273 -0.876 . . . . 0.0 110.151 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 70.9 p 48.62 41.42 17.48 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.114 -177.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 10.0 m . . . . . 0 C--O 1.249 1.06 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.319 -177.837 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 N-CA-C 112.235 -0.346 . . . . 0.0 112.235 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.2 m -129.81 36.45 4.06 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.977 0.418 . . . . 0.0 110.442 -176.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.0 tp10 -131.11 -81.28 0.53 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.843 -178.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -77.38 91.72 3.88 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 81.4 mtm180 -95.2 -90.06 0.23 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.292 -174.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 -124.72 137.23 54.35 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.933 178.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.7 m-70 -111.15 61.89 0.61 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.585 0.707 . . . . 0.0 110.385 178.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 49.6 m -100.52 21.11 13.77 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.247 173.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.7 m -65.36 -49.33 69.78 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.621 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 47.79 40.81 13.12 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 170.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -71.08 106.86 3.87 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.121 174.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.25 154.86 18.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.432 0.634 . . . . 0.0 112.311 -166.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.475 ' HA ' ' O ' ' A' ' 64' ' ' ASN . 28.5 m170 -112.72 133.41 54.75 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 175.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.53 HG21 HD22 ' A' ' 54' ' ' LEU . 33.1 t -103.21 150.01 6.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 1.083 HG11 ' HG3' ' A' ' 78' ' ' PRO . 13.7 p -89.8 127.88 42.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.028 0.442 . . . . 0.0 111.685 -174.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.99 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.9 tt -119.36 114.92 23.09 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 170.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.716 ' HE3' ' HD3' ' A' ' 78' ' ' PRO . 46.3 mttm -104.21 147.71 27.15 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.511 177.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.612 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 3.7 mm? -97.71 140.01 32.73 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.954 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 49.0 m95 -129.53 173.63 10.4 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 -179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.59 ' HD3' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -63.33 -34.56 77.97 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -177.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.59 ' N ' ' HD3' ' A' ' 20' ' ' LYS . 16.9 t -115.15 -17.54 11.38 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 121.002 -0.279 . . . . 0.0 111.285 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 32' ' ' SER . . . -158.79 -157.64 8.62 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.514 -1.327 . . . . 0.0 114.129 -173.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.99 ' HB2' HD21 ' A' ' 16' ' ' LEU . 24.0 p90 -147.55 140.54 25.01 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 122.724 0.41 . . . . 0.0 110.226 -176.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.714 ' HB2' ' HE1' ' A' ' 19' ' ' TRP . 40.7 t -111.39 125.83 54.28 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.467 179.069 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.666 ' H ' HD12 ' A' ' 25' ' ' LEU . 0.0 OUTLIER -116.12 44.21 2.0 Allowed 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.109 -178.42 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 28.7 t70 60.59 -65.75 0.05 Allowed 'General case' 0 N--CA 1.469 0.478 0 O-C-N 124.137 0.898 . . . . 0.0 112.754 -175.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.615 HD21 HD13 ' A' ' 25' ' ' LEU . 7.8 p30 -53.65 -42.88 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.234 0.827 . . . . 0.0 113.234 -170.037 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -126.83 27.16 4.95 Favored Glycine 0 CA--C 1.51 -0.274 0 C-N-CA 119.873 -1.156 . . . . 0.0 113.239 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.523 ' O ' ' HA ' ' A' ' 24' ' ' SER . 40.7 mt-10 49.44 -154.34 0.11 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 179.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.954 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 3.6 tt -73.09 113.32 10.01 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.476 0.655 . . . . 0.0 109.963 -175.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.633 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 61.7 mtt180 -114.89 119.75 37.63 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.154 177.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.524 ' HA ' ' CA ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER -59.64 142.63 52.53 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.98 0.419 . . . . 0.0 111.962 -178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -63.4 -22.86 67.13 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.275 -176.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 52.1 mt-30 -81.44 -30.02 33.62 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.673 -173.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.679 ' HB2' ' ND2' ' A' ' 38' ' ' ASN . 2.1 m-20 -65.7 122.42 80.52 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.089 -178.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 37.7 Cg_exo -60.31 -21.75 68.24 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.442 2.761 . . . . 0.0 113.727 -172.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.6 m -74.55 -24.94 59.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 122.099 0.952 . . . . 0.0 109.581 -177.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.679 ' ND2' ' HB2' ' A' ' 35' ' ' ASP . 11.5 m-20 -92.44 -16.97 25.18 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.299 -1.319 . . . . 0.0 110.542 -175.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.39 -30.89 69.88 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.489 177.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -54.8 -54.48 41.59 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.055 175.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.539 ' CZ ' ' HG2' ' A' ' 53' ' ' GLU . 88.2 m-85 -58.0 -59.99 4.42 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.766 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 42' ' ' LEU . 10.8 mt -38.57 -66.0 0.31 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.53 -1.213 . . . . 0.0 112.749 -178.023 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.659 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 35.3 tt0 -67.44 -43.16 81.82 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.025 -173.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.4 m -59.37 -41.61 89.69 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 118.317 0.508 . . . . 0.0 110.302 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.468 HG13 ' O ' ' A' ' 41' ' ' PHE . 66.9 mt -73.54 -25.08 20.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-O 121.329 0.585 . . . . 0.0 109.843 -178.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 15.5 mtp180 -76.62 -34.17 58.36 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.165 174.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.659 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 33.2 mmt180 -73.88 -12.8 60.78 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.147 178.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.01 21.53 52.34 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.737 -0.744 . . . . 0.0 111.452 -174.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -108.23 167.64 9.87 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.457 ' HA ' ' HD3' ' A' ' 51' ' ' PRO . 14.7 p -105.66 131.77 21.46 Favored Pre-proline 0 C--N 1.318 -0.801 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.741 -174.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.627 ' HD2' HD12 ' A' ' 54' ' ' LEU . 11.0 Cg_exo -71.3 143.18 42.99 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 123.005 2.47 . . . . 0.0 111.561 175.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -63.67 -24.07 67.63 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.592 -174.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.539 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.0 mp0 -56.87 -38.92 73.41 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.994 0.426 . . . . 0.0 110.987 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.627 HD12 ' HD2' ' A' ' 51' ' ' PRO . 14.7 mt -86.23 -34.27 20.49 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.677 -177.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.9 mmt180 -67.12 -36.49 82.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.536 176.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.487 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 5.7 mmp_? -85.34 41.1 0.87 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.457 0.646 . . . . 0.0 109.901 171.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 8.3 tt -148.22 -54.19 0.2 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 176.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.7 ' HB3' ' HB ' ' A' ' 63' ' ' VAL . . . -93.55 149.21 21.41 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 115.366 -0.833 . . . . 0.0 111.11 177.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 56.0 m-70 -118.94 -166.15 1.21 Allowed 'General case' 0 C--N 1.315 -0.933 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 174.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 76.34 -65.98 2.66 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.235 -0.983 . . . . 0.0 111.564 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 145.89 -28.75 1.72 Allowed Glycine 0 CA--C 1.495 -1.202 0 C-N-CA 120.621 -0.799 . . . . 0.0 113.882 176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -79.0 55.89 1.86 Allowed 'General case' 0 N--CA 1.44 -0.972 0 CA-C-O 121.264 0.554 . . . . 0.0 110.821 177.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.7 ' HB ' ' HB3' ' A' ' 58' ' ' ALA . 2.6 p -90.31 102.05 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.033 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.475 ' O ' ' HA ' ' A' ' 13' ' ' HIS . 1.7 t-20 -129.36 166.63 19.13 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.497 -173.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.58 HD11 ' HB2' ' A' ' 16' ' ' LEU . 6.0 tt -126.73 134.18 50.71 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.765 -173.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -104.86 151.37 23.92 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 176.205 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.502 ' HA ' ' O ' ' A' ' 16' ' ' LEU . 68.2 mtt -116.28 135.13 54.15 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.129 0.49 . . . . 0.0 112.151 -174.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.52 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 63.7 mt-10 -121.54 136.5 54.95 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.064 -0.971 . . . . 0.0 108.755 169.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 7.9 t70 -105.87 110.21 22.42 Favored 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.646 -177.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 42.3 m-70 -135.85 46.25 2.34 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.601 ' HG3' ' HB3' ' A' ' 18' ' ' LEU . 83.4 mtm180 -66.88 -44.66 80.32 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.909 -171.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -89.34 21.82 3.15 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.46 0.648 . . . . 0.0 110.185 177.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.503 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 4.4 mt-10 -115.01 -14.51 11.84 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.192 -176.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.1 p30 52.04 174.68 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 124.522 1.129 . . . . 0.0 113.156 -172.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.756 ' HB2' HD12 ' A' ' 30' ' ' LEU . 1.5 t80 -57.64 110.69 0.93 Allowed 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -163.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.522 ' O ' HG13 ' A' ' 76' ' ' VAL . 9.2 p -134.15 94.79 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.464 -1.244 . . . . 0.0 109.044 171.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.605 ' HG3' ' HG3' ' A' ' 79' ' ' LYS . 5.5 ptpt -88.68 163.04 37.1 Favored Pre-proline 0 C--N 1.313 -1.022 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.598 -167.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 1.083 ' HG3' HG11 ' A' ' 15' ' ' VAL . 63.9 Cg_endo -77.31 -19.93 12.98 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.525 2.15 . . . . 0.0 110.781 179.441 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.605 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 10.9 ptpt -86.59 79.75 8.81 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.262 -1.335 . . . . 0.0 109.86 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 138.64 -62.91 0.56 Allowed Glycine 0 N--CA 1.445 -0.728 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.791 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.64 -51.75 8.86 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.737 0.303 . . . . 0.0 110.597 179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.6 t80 71.11 -9.76 0.83 Allowed 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 170.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -64.33 -27.76 69.24 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 -175.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 62.02 -165.54 0.23 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.394 0.434 . . . . 0.0 111.89 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 80.5 t80 -167.11 120.31 0.97 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.642 176.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 90' ' ' GLN . 20.8 p -90.36 -62.52 1.44 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.173 -178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 59.0 71.07 0.82 Allowed Glycine 0 CA--C 1.519 0.288 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.861 176.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 72.47 -42.93 0.55 Allowed 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.423 0.689 . . . . 0.0 111.546 -179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 168.4 -39.01 0.22 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 -179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 86' ' ' THR . 6.9 tt0 56.42 65.04 1.51 Allowed 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.529 0.681 . . . . 0.0 111.399 172.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -168.0 -45.61 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.036 172.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 90.3 mt 46.48 48.01 14.0 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.926 0.766 . . . . 0.0 112.056 171.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -176.42 -129.33 1.22 Allowed Glycine 0 N--CA 1.443 -0.848 0 C-N-CA 120.682 -0.771 . . . . 0.0 111.886 -178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.5 m 57.0 42.0 26.8 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.602 0.715 . . . . 0.0 109.887 -177.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.5 t -75.02 111.57 10.38 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.363 -175.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.475 ' N ' ' HD3' ' A' ' 97' ' ' PRO . . . -141.82 59.18 9.24 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.324 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.806 ' HD2' HG21 ' A' ' 102' ' ' THR . 93.2 Cg_endo -91.66 -158.75 0.07 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.921 0 C-N-CA 123.026 2.484 . . . . 0.0 111.645 -177.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -119.8 83.01 1.97 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.39 0.614 . . . . 0.0 110.716 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.3 t -87.38 -57.91 3.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 171.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 14.3 tp -175.62 -73.41 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.937 -1.028 . . . . 0.0 108.6 173.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 5.2 p -99.89 83.71 2.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.905 175.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . 0.806 HG21 ' HD2' ' A' ' 97' ' ' PRO . 7.9 m . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.077 -0.963 . . . . 0.0 110.448 -175.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.957 0 N-CA-C 112.434 -0.266 . . . . 0.0 112.434 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -137.6 122.76 19.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.435 ' HG3' ' HG2' ' A' ' 4' ' ' LYS . 10.8 pt-20 -172.88 -41.89 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.742 ' HB3' ' HB3' ' A' ' 7' ' ' HIS . 65.3 mmtt -92.72 112.87 24.98 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 174.715 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.6 tpp180 -44.75 -70.85 0.09 Allowed 'General case' 0 N--CA 1.467 0.376 0 O-C-N 124.037 0.835 . . . . 0.0 112.682 -170.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -106.85 -6.07 17.92 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.173 0.511 . . . . 0.0 109.749 179.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.742 ' HB3' ' HB3' ' A' ' 4' ' ' LYS . 6.5 t-160 -87.55 32.5 0.72 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.862 178.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -76.55 63.7 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.733 0.778 . . . . 0.0 109.409 175.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.579 ' HA ' ' CD2' ' A' ' 59' ' ' HIS . 1.0 OUTLIER -145.35 54.83 1.2 Allowed 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 -179.078 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -53.61 -39.88 65.28 Favored 'General case' 0 C--O 1.227 -0.086 0 CA-C-N 114.61 -1.177 . . . . 0.0 110.15 -178.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.494 ' HA ' ' O ' ' A' ' 62' ' ' GLN . 60.6 m-20 40.0 90.05 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.509 0 O-C-N 124.608 1.192 . . . . 0.0 112.596 170.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.596 HG12 ' HB2' ' A' ' 58' ' ' ALA . 11.7 p -92.32 136.94 23.31 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.407 -168.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -111.63 104.86 13.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.579 -1.267 . . . . 0.0 107.579 166.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.818 HG11 HD13 ' A' ' 54' ' ' LEU . 2.5 p -102.83 134.28 44.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-O 121.542 0.687 . . . . 0.0 111.347 -171.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.6 t -91.53 122.11 42.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.571 177.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.528 HD22 ' HG2' ' A' ' 67' ' ' MET . 9.4 tt -111.18 132.32 54.41 Favored 'General case' 0 N--CA 1.436 -1.162 0 CA-C-N 115.136 -0.938 . . . . 0.0 109.12 176.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.515 ' HE2' ' HE2' ' A' ' 77' ' ' LYS . 63.3 mttm -119.52 144.18 47.18 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 178.495 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.449 ' HB2' ' HA ' ' A' ' 69' ' ' ASP . 25.3 mt -98.99 141.67 31.45 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.953 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 55.0 m95 -129.8 -173.29 2.99 Favored 'General case' 0 C--N 1.315 -0.893 0 O-C-N 123.209 0.318 . . . . 0.0 110.642 -175.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.55 ' HE2' ' OD1' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -75.32 -37.32 60.81 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.908 0.385 . . . . 0.0 110.785 176.815 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 57.8 m -87.41 -46.53 9.55 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.826 0.346 . . . . 0.0 111.179 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.688 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -163.43 -132.25 1.32 Allowed Glycine 0 N--CA 1.442 -0.915 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.64 -175.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.64 ' HZ ' ' CD2' ' A' ' 41' ' ' PHE . 30.6 p90 -146.11 155.9 43.07 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 -177.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.475 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 98.8 p -125.28 144.57 50.41 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.711 0.291 . . . . 0.0 110.719 178.156 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' ND2' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -114.01 -160.96 0.75 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 179.443 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.507 ' HB2' HG23 ' A' ' 14' ' ' VAL . 15.6 t70 -85.78 -30.08 23.33 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.564 0.697 . . . . 0.0 109.599 175.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.509 ' ND2' ' HB2' ' A' ' 25' ' ' LEU . 9.6 p30 -77.41 -27.22 52.26 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.461 -176.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -152.45 168.0 31.47 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.5 -0.857 . . . . 0.0 113.23 -172.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -80.47 -165.84 0.95 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 114.955 -0.622 . . . . 0.0 111.258 -177.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.953 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.7 OUTLIER -63.32 115.97 5.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.317 176.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.688 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 56.6 mtt180 -108.73 128.04 54.52 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 171.337 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.468 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 10.5 m -74.15 137.0 42.91 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.606 0.241 . . . . 0.0 110.922 -175.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 46.4 m-85 -53.36 -27.72 25.18 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -168.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -72.16 -30.2 64.77 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.206 0.447 . . . . 0.0 112.206 -177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.602 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 2.0 t70 -58.3 127.43 80.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.025 0.44 . . . . 0.0 111.219 179.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 11.1 Cg_exo -70.93 -5.0 15.96 Favored 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 123.012 2.475 . . . . 0.0 114.048 -174.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.6 t -90.09 -35.4 15.46 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 120.564 -0.454 . . . . 0.0 109.823 -178.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.7 p30 -86.33 -18.54 31.66 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 120.965 0.412 . . . . 0.0 110.534 176.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -50.9 -32.84 21.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.578 171.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -53.02 -53.98 42.04 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.701 174.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.667 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 73.8 m-85 -56.55 -58.62 7.28 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.536 178.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 ' O ' ' HG2' ' A' ' 46' ' ' ARG . 6.2 mp -40.04 -65.9 0.36 Allowed 'General case' 0 C--N 1.327 -0.375 0 O-C-N 124.518 1.136 . . . . 0.0 112.309 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.685 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 39.2 mm-40 -62.71 -50.2 72.07 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.058 -175.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.2 m -61.75 -37.69 85.21 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.611 -0.436 . . . . 0.0 111.151 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' PHE . 61.4 mt -69.88 -40.01 78.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.658 0.266 . . . . 0.0 110.877 -177.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 42' ' ' LEU . 1.7 ptp180 -73.73 -29.69 62.39 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 120.901 -0.32 . . . . 0.0 111.143 178.712 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.685 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 23.9 mmm180 -70.35 -38.47 74.84 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.134 0.492 . . . . 0.0 110.957 175.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.71 9.4 11.17 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.631 -177.106 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -86.34 -179.11 6.62 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.902 0.382 . . . . 0.0 109.993 178.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 63' ' ' VAL . 74.6 t -114.38 129.93 24.45 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 -176.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -73.01 132.54 18.39 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.568 2.178 . . . . 0.0 111.373 173.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -61.43 -29.95 70.26 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.586 -173.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.483 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 17.6 mp0 -55.41 -44.46 76.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.602 177.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.818 HD13 HG11 ' A' ' 14' ' ' VAL . 3.1 mt -86.24 -34.55 20.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.553 -175.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -61.79 -41.24 97.48 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.901 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.421 ' NE ' ' HA ' ' A' ' 56' ' ' ARG . 7.3 tpm_? -85.53 13.04 7.38 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.238 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.495 HD23 HG21 ' A' ' 12' ' ' VAL . 15.1 tp -106.68 -34.5 7.29 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 171.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.596 ' HB2' HG12 ' A' ' 12' ' ' VAL . . . -79.52 174.49 11.52 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.503 -1.226 . . . . 0.0 108.362 163.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.579 ' CD2' ' HA ' ' A' ' 9' ' ' SER . 15.8 p80 -75.32 18.33 0.22 Allowed 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.036 177.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.404 ' H ' ' C ' ' A' ' 58' ' ' ALA . . . 77.29 41.77 20.47 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 -165.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 63' ' ' VAL . . . -142.55 -125.63 2.02 Favored Glycine 0 N--CA 1.447 -0.599 0 N-CA-C 111.684 -0.566 . . . . 0.0 111.684 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.494 ' O ' ' HA ' ' A' ' 11' ' ' ASP . 8.9 tt0 -52.84 108.73 0.34 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 121.336 0.588 . . . . 0.0 110.896 177.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.587 HG11 HG11 ' A' ' 50' ' ' VAL . 2.4 p -138.29 103.89 2.51 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.86 -179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . 0.425 HD22 ' HA ' ' A' ' 64' ' ' ASN . 2.0 t-20 -134.87 160.11 39.29 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.019 -179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.491 ' CB ' HG13 ' A' ' 14' ' ' VAL . 1.4 pt? -135.47 165.38 25.63 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.215 0.531 . . . . 0.0 111.49 -176.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -127.19 140.75 52.03 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.035 -0.984 . . . . 0.0 108.52 171.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . 0.528 ' HG2' HD22 ' A' ' 16' ' ' LEU . 75.4 mtm -110.73 123.24 49.67 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.542 0.687 . . . . 0.0 111.905 -177.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.487 ' HG2' ' HG2' ' A' ' 90' ' ' GLN . 49.8 mt-10 -104.79 156.07 18.33 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.865 177.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 18' ' ' LEU . 14.6 t70 -110.26 115.81 30.37 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-O 121.22 0.533 . . . . 0.0 110.614 176.371 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.451 ' O ' ' HB3' ' A' ' 73' ' ' GLU . 91.6 m-70 -138.64 40.88 2.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 176.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 74.0 mtp180 -74.58 139.03 43.41 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 -177.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.476 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 14.0 t70 74.23 -3.07 2.63 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 124.2 0.937 . . . . 0.0 110.95 -172.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.512 ' O ' ' HB2' ' A' ' 74' ' ' ASP . 8.7 tp10 -84.23 -30.78 25.43 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.337 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.55 ' OD1' ' HE2' ' A' ' 20' ' ' LYS . 17.4 m-20 79.09 156.74 0.16 Allowed 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.427 -177.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.783 ' HB2' HD12 ' A' ' 30' ' ' LEU . 45.5 t80 -60.8 122.75 15.61 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -167.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.683 HG12 ' HE2' ' A' ' 79' ' ' LYS . 9.8 m -150.16 102.62 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.866 173.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.884 ' HB3' ' HD3' ' A' ' 78' ' ' PRO . 11.0 ttmt -169.07 -76.48 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.889 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 167.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.884 ' HD3' ' HB3' ' A' ' 77' ' ' LYS . 15.6 Cg_exo -71.81 8.42 1.31 Allowed 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 123.311 2.674 . . . . 0.0 113.348 -178.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.683 ' HE2' HG12 ' A' ' 76' ' ' VAL . 35.1 pttt -89.68 31.41 0.94 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.94 0.4 . . . . 0.0 111.699 -174.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 79.99 -55.52 4.54 Favored Glycine 0 C--N 1.331 0.253 0 N-CA-C 114.294 0.478 . . . . 0.0 114.294 171.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.24 -63.69 1.04 Allowed 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 -174.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 30.0 p90 -157.43 143.26 17.51 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -82.72 1.51 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.113 -178.176 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 55.2 36.18 26.46 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.837 169.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -87.64 115.58 25.18 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.797 0.332 . . . . 0.0 110.368 -178.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 11.0 t -141.36 146.36 36.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.826 179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -107.74 -35.75 2.54 Favored Glycine 0 N--CA 1.447 -0.61 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.639 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -64.8 122.28 16.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -177.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 92' ' ' LEU . . . 93.71 -24.7 24.83 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.892 -0.67 . . . . 0.0 111.989 -179.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.487 ' HG2' ' HG2' ' A' ' 68' ' ' GLU . 6.2 tp-100 -99.24 -61.96 1.3 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.003 0.43 . . . . 0.0 110.215 -178.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -114.72 47.32 1.27 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.325 0.583 . . . . 0.0 109.584 179.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.641 ' H ' HD23 ' A' ' 92' ' ' LEU . 2.3 pt? -82.04 54.72 2.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.206 -174.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 93.38 29.78 9.84 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.427 -174.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.5 m -78.77 2.49 19.58 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.032 0.444 . . . . 0.0 111.12 -179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.9 t -145.19 32.53 1.1 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.685 0.755 . . . . 0.0 109.924 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . -145.58 121.39 5.81 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.733 -177.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 21.1 Cg_exo -66.54 -25.58 47.64 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.918 2.412 . . . . 0.0 111.59 176.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -90.17 110.64 21.65 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.333 -0.849 . . . . 0.0 110.081 176.182 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 21.3 t -84.87 74.99 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-O 121.603 0.716 . . . . 0.0 110.715 -176.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 12.3 tp -133.82 50.61 2.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.138 -0.937 . . . . 0.0 108.821 177.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 47.8 m 75.33 -57.25 0.6 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.012 -1.449 . . . . 0.0 110.177 -174.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 58.2 m . . . . . 0 C--O 1.252 1.202 0 CA-C-O 118.53 -0.748 . . . . 0.0 109.673 174.256 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.67 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.6 m -87.33 98.38 11.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.822 0.344 . . . . 0.0 111.119 -176.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -83.37 -64.83 1.09 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.409 0.623 . . . . 0.0 109.322 173.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' A' ' 4' ' ' LYS . 4.6 mmmp? -129.18 -75.64 0.55 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.255 177.319 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? 57.69 -172.97 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.361 0.413 . . . . 0.0 110.796 -176.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 57.83 71.68 0.56 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.516 171.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -113.6 90.8 3.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.89 0.852 . . . . 0.0 110.466 178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.3 m -130.74 175.42 9.05 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.305 -0.862 . . . . 0.0 109.709 178.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.9 m 60.17 32.41 20.88 Favored 'General case' 0 N--CA 1.461 0.119 0 CA-C-O 121.461 0.648 . . . . 0.0 110.475 179.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -84.83 -39.2 18.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.985 -177.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.506 ' CG ' ' HB3' ' A' ' 62' ' ' GLN . 72.6 m-20 65.67 125.49 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.27 0 O-C-N 123.892 0.745 . . . . 0.0 111.613 178.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.577 ' HB ' ' HB2' ' A' ' 58' ' ' ALA . 7.4 p -91.92 131.61 38.56 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 121.719 0.771 . . . . 0.0 112.164 -169.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 60.0 m80 -103.98 110.85 23.15 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.491 ' HB ' ' HA ' ' A' ' 65' ' ' LEU . 5.3 t -102.96 103.71 15.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.207 -170.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.853 HG11 ' HG2' ' A' ' 78' ' ' PRO . 2.9 p -89.64 104.55 15.18 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.031 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.201 174.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.796 HD21 ' HB2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -103.76 113.92 27.79 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.856 -174.492 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.631 ' HD2' ' HA ' ' A' ' 77' ' ' LYS . 64.8 mttm -104.43 134.26 47.93 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.446 177.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.405 ' HB3' ' HA ' ' A' ' 69' ' ' ASP . 18.8 tp -101.14 112.65 25.19 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.98 -1.009 . . . . 0.0 108.597 -173.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.888 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 21.1 m95 -108.81 -168.63 1.37 Allowed 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 121.405 0.621 . . . . 0.0 111.964 -172.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -75.17 -39.6 60.2 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.607 179.421 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.5 t -91.86 -32.66 15.24 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.994 0.426 . . . . 0.0 110.848 -175.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.486 ' HA3' ' HA ' ' A' ' 32' ' ' SER . . . -171.07 -141.01 3.19 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.298 -0.954 . . . . 0.0 112.694 -176.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.796 ' HB2' HD21 ' A' ' 16' ' ' LEU . 54.1 p90 -141.76 143.93 33.74 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 -174.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.569 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.0 p -121.41 142.31 50.14 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.549 0.214 . . . . 0.0 110.82 178.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.422 ' N ' HD12 ' A' ' 25' ' ' LEU . 1.5 mp -113.71 -165.69 1.02 Allowed 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -81.71 -44.13 17.51 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.408 HD21 HD22 ' A' ' 25' ' ' LEU . 1.6 p-10 -59.11 -41.11 87.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.669 -1.15 . . . . 0.0 111.964 178.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -135.26 163.36 24.87 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.162 -0.542 . . . . 0.0 111.831 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -91.4 -165.6 1.39 Allowed 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.689 0.244 . . . . 0.0 110.654 -178.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.888 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.1 OUTLIER -56.55 109.55 0.64 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.446 0.641 . . . . 0.0 109.897 -176.417 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.744 ' HD3' ' OD1' ' A' ' 38' ' ' ASN . 45.9 mtt180 -110.53 123.4 49.86 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.848 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.486 ' HA ' ' HA3' ' A' ' 22' ' ' GLY . 2.5 p -64.81 142.35 58.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.102 0.477 . . . . 0.0 111.887 -178.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -62.02 -19.91 63.37 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.755 -174.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -80.25 -28.88 38.37 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.801 -171.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.743 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 14.2 t70 -69.02 131.64 90.72 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.137 -176.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 33.0 Cg_exo -60.33 -23.74 75.42 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 123.685 2.923 . . . . 0.0 114.107 -175.395 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.2 t -77.96 -27.86 49.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 122.058 0.932 . . . . 0.0 108.701 179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.744 ' OD1' ' HD3' ' A' ' 31' ' ' ARG . 20.5 m-20 -87.09 -21.81 25.8 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.062 -178.323 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -61.12 -29.85 70.02 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.883 172.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.558 HE21 ' N ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -53.3 -49.05 67.82 Favored 'General case' 0 C--O 1.23 0.074 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.068 173.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CZ ' ' HG3' ' A' ' 53' ' ' GLU . 95.1 m-85 -64.49 -58.84 5.29 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.079 178.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.7 mt -52.31 -42.86 64.15 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.229 -0.896 . . . . 0.0 112.033 -174.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 9.6 tp10 -71.38 -49.96 36.86 Favored 'General case' 0 C--N 1.328 -0.345 0 O-C-N 123.127 0.267 . . . . 0.0 110.923 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 66.9 m -61.09 -43.74 98.43 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 120.752 0.31 . . . . 0.0 110.811 -179.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 69.2 mt -72.06 -27.97 28.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.304 0.574 . . . . 0.0 110.149 -178.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.51 ' HD3' ' OE2' ' A' ' 43' ' ' GLU . 37.9 ttt180 -63.99 -48.27 77.07 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.408 174.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 18.5 mmt85 -69.57 -42.57 74.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.001 -179.035 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 114.22 29.09 2.86 Favored Glycine 0 N--CA 1.447 -0.569 0 N-CA-C 110.687 -0.965 . . . . 0.0 110.687 -172.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 88.1 mt-10 -108.31 172.71 6.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.0 -0.6 . . . . 0.0 109.728 -178.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.57 119.56 67.09 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.219 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.45 ' HB2' ' HG ' ' A' ' 54' ' ' LEU . 43.2 Cg_exo -56.94 126.99 24.01 Favored 'Trans proline' 0 N--CA 1.462 -0.35 0 C-N-CA 122.213 1.942 . . . . 0.0 110.806 170.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.644 ' O ' ' HG2' ' A' ' 56' ' ' ARG . . . -57.62 -31.83 66.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.195 -175.294 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.572 ' HG3' ' CZ ' ' A' ' 41' ' ' PHE . 36.0 mm-40 -55.6 -28.72 56.76 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.924 178.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' HB2' ' A' ' 51' ' ' PRO . 28.1 mt -75.21 -38.07 60.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.993 0.425 . . . . 0.0 110.084 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -73.33 -27.29 61.43 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.008 175.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 52' ' ' ALA . 38.0 mmt180 -78.53 -0.25 28.87 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.089 176.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -113.02 -59.53 2.01 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.577 ' HB2' ' HB ' ' A' ' 12' ' ' VAL . . . -98.6 136.36 38.8 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.404 0.621 . . . . 0.0 111.49 -179.317 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 88.7 m-70 -115.73 85.4 2.28 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.24 -0.891 . . . . 0.0 108.82 176.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -168.64 -40.99 0.03 OUTLIER Glycine 0 CA--C 1.504 -0.655 0 N-CA-C 109.992 -1.243 . . . . 0.0 109.992 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 117.31 -15.52 13.14 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.797 -0.716 . . . . 0.0 113.431 173.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.506 ' HB3' ' CG ' ' A' ' 11' ' ' ASP . 7.0 tt0 -80.33 119.21 22.75 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 120.734 0.302 . . . . 0.0 110.345 178.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.465 HG12 ' CG1' ' A' ' 12' ' ' VAL . 12.8 m -127.75 103.33 10.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 121.648 0.737 . . . . 0.0 110.527 177.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -104.8 103.94 13.64 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.254 179.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 16' ' ' LEU . 9.1 tt -113.83 120.65 41.47 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.11 0.481 . . . . 0.0 110.585 -177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -112.48 128.22 56.27 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.106 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 37.1 mtt -89.62 129.45 36.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.074 0.464 . . . . 0.0 111.621 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 57.5 mt-10 -120.12 146.88 45.54 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.247 172.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . 0.405 ' HA ' ' HB3' ' A' ' 18' ' ' LEU . 16.7 t70 -103.62 110.21 22.18 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.269 0.557 . . . . 0.0 110.697 179.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.618 ' O ' ' HB2' ' A' ' 73' ' ' GLU . 75.7 m-70 -128.89 30.15 5.12 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.571 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.62 ' HG2' ' O ' ' A' ' 19' ' ' TRP . 66.6 mtp180 -68.17 145.89 53.92 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 -179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.506 ' H ' ' HB3' ' A' ' 20' ' ' LYS . 31.6 t70 71.07 -10.0 0.81 Allowed 'General case' 0 CA--C 1.538 0.512 0 O-C-N 124.005 0.816 . . . . 0.0 111.52 -175.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.618 ' HB2' ' O ' ' A' ' 70' ' ' HIS . 62.2 mt-10 -81.47 -33.9 31.73 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 120.961 0.41 . . . . 0.0 110.632 173.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 73' ' ' GLU . 1.2 m-20 74.08 159.52 0.22 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 114.986 -1.007 . . . . 0.0 111.446 -176.059 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.803 ' HB2' HD12 ' A' ' 30' ' ' LEU . 65.8 t80 -69.84 144.73 52.49 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 114.455 1.28 . . . . 0.0 114.455 -162.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.403 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 10.9 p -153.34 -41.48 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 CA-C-N 113.943 -1.48 . . . . 0.0 108.742 171.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.685 ' HB3' ' CE1' ' A' ' 75' ' ' PHE . 16.5 ptmt 54.85 174.82 0.04 OUTLIER Pre-proline 0 N--CA 1.474 0.765 0 C-N-CA 124.918 1.287 . . . . 0.0 112.126 -179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.853 ' HG2' HG11 ' A' ' 15' ' ' VAL . 23.2 Cg_exo -68.1 -49.47 0.99 Allowed 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 121.908 1.738 . . . . 0.0 111.738 177.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.513 ' HG3' ' HG3' ' A' ' 77' ' ' LYS . 59.0 mttm 70.02 -54.32 0.62 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.418 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 158.71 -10.81 0.2 Allowed Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.49 -0.644 . . . . 0.0 111.49 -178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.11 -70.59 0.55 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.83 0.348 . . . . 0.0 110.821 178.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -146.3 153.94 41.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.915 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.613 ' HE2' ' HZ ' ' A' ' 85' ' ' PHE . 22.0 pttm -92.52 93.9 8.79 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.074 0.464 . . . . 0.0 110.583 178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.74 127.18 22.36 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.916 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.613 ' HZ ' ' HE2' ' A' ' 83' ' ' LYS . 93.3 m-85 -102.31 163.59 12.15 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.919 -178.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 99.0 m -131.3 117.47 19.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.963 171.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -159.07 -42.95 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 92' ' ' LEU . 42.3 mt-10 -70.96 -36.68 72.65 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.998 0.427 . . . . 0.0 110.232 178.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . -75.69 -11.34 84.57 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.29 178.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 -92.73 -64.59 1.08 Allowed 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.88 -0.188 . . . . 0.0 110.942 177.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -133.42 -24.32 1.81 Allowed 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 121.111 -0.236 . . . . 0.0 111.557 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.732 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 5.9 tt 70.65 -61.13 0.48 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.896 0.747 . . . . 0.0 110.939 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.66 130.52 1.56 Allowed Glycine 0 N--CA 1.444 -0.779 0 N-CA-C 111.007 -0.837 . . . . 0.0 111.007 -178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.7 p -85.48 27.72 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.135 0.493 . . . . 0.0 111.426 -176.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 11.3 m -68.94 -23.04 64.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.591 0.71 . . . . 0.0 109.532 174.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -128.38 86.83 56.81 Favored Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 115.257 -0.883 . . . . 0.0 109.152 171.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -58.76 -39.54 81.03 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.978 2.452 . . . . 0.0 112.797 -175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -118.22 132.26 56.33 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.535 -179.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.0 p -78.99 63.68 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.511 0 CA-C-O 122.478 1.133 . . . . 0.0 109.896 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 5.2 tt -167.48 -57.02 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.066 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 42.3 m -69.67 145.75 52.14 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.385 -0.825 . . . . 0.0 111.911 -176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.248 1.004 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.368 176.615 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.796 0 N-CA-C 112.0 -0.44 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.1 p -86.16 -34.06 20.66 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.172 0.51 . . . . 0.0 110.965 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -75.05 -46.01 37.74 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.723 -176.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 4' ' ' LYS . 13.5 ptpt -121.89 98.02 5.76 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.493 174.263 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 24.0 ptt180 -111.81 164.74 12.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.169 -172.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -148.83 -35.04 0.2 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.893 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.5 p80 -131.09 75.2 1.64 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.679 0.752 . . . . 0.0 110.287 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 19.5 m -145.71 157.38 43.95 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.234 178.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.2 t 56.98 43.9 23.8 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.711 0.767 . . . . 0.0 109.082 -172.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 15.3 mm100 -91.73 46.52 1.29 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.6 -175.273 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.538 ' OD1' ' HG2' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -23.34 130.58 0.02 OUTLIER 'General case' 0 C--O 1.237 0.439 0 CA-C-N 113.654 -1.612 . . . . 0.0 113.81 173.348 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.713 HG13 ' HB2' ' A' ' 58' ' ' ALA . 0.2 OUTLIER -85.5 117.24 30.11 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 CA-C-O 121.733 0.777 . . . . 0.0 109.225 168.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -100.4 104.24 15.66 Favored 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 172.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.507 HG11 HD13 ' A' ' 54' ' ' LEU . 3.4 t -99.46 102.1 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.239 -164.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.633 HG13 ' HD3' ' A' ' 77' ' ' LYS . 2.6 p -82.04 110.83 17.73 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.391 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.058 176.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.804 HD21 ' HB2' ' A' ' 23' ' ' PHE . 1.2 tt -102.89 111.32 23.59 Favored 'General case' 0 N--CA 1.436 -1.135 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -103.73 133.88 47.98 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 176.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.465 HD12 ' OH ' ' A' ' 33' ' ' TYR . 3.5 tp -99.53 120.33 39.48 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.934 ' CD1' ' HG ' ' A' ' 30' ' ' LEU . 46.2 m95 -109.57 -169.57 1.5 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.412 -173.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.497 ' HD2' ' N ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -80.42 -36.1 34.2 Favored 'General case' 0 C--N 1.322 -0.621 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.42 -177.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' ' 20' ' ' LYS . 7.1 p -96.06 -32.78 12.37 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.074 -177.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.642 ' HA3' ' O ' ' A' ' 31' ' ' ARG . . . -166.6 -155.59 9.04 Favored Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.494 -0.86 . . . . 0.0 112.947 -177.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.804 ' HB2' HD21 ' A' ' 16' ' ' LEU . 21.0 p90 -131.19 161.39 32.29 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.7 -0.482 . . . . 0.0 109.7 -177.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.435 ' CB ' ' HE1' ' A' ' 19' ' ' TRP . 96.5 p -138.22 144.36 40.58 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.347 179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.595 HD13 ' HG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -105.71 -179.06 3.83 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.527 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -67.65 -18.06 64.82 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.314 0.578 . . . . 0.0 110.379 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.435 ' OD1' ' HB2' ' A' ' 25' ' ' LEU . 32.9 p30 -83.3 -16.11 47.49 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.673 -173.007 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -175.03 -151.58 8.62 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 119.788 -1.196 . . . . 0.0 113.603 -174.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -104.79 -169.89 1.68 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.454 0.645 . . . . 0.0 112.679 -170.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.934 ' HG ' ' CD1' ' A' ' 19' ' ' TRP . 0.0 OUTLIER -79.05 118.62 21.2 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.371 -174.473 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.642 ' O ' ' HA3' ' A' ' 22' ' ' GLY . 48.7 mtp85 -111.15 128.32 55.86 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 174.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.443 ' HA ' ' O ' ' A' ' 21' ' ' SER . 48.3 t -67.33 133.46 49.68 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.472 -179.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.465 ' OH ' HD12 ' A' ' 18' ' ' LEU . 19.7 m-85 -55.76 -19.77 12.36 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.619 0.574 . . . . 0.0 112.343 -170.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -70.03 -35.01 73.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.024 179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.567 ' HB3' ' ND2' ' A' ' 38' ' ' ASN . 1.2 t70 -59.81 123.46 71.8 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 121.237 0.541 . . . . 0.0 111.299 -178.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.519 ' HD3' ' HA ' ' A' ' 35' ' ' ASP . 27.8 Cg_exo -63.36 -15.67 49.78 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.215 2.61 . . . . 0.0 113.436 -176.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.1 t -77.48 -35.61 53.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.582 0.229 . . . . 0.0 110.452 -178.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.722 ' HA ' ' CD2' ' A' ' 41' ' ' PHE . 10.6 p30 -92.2 -21.33 20.43 Favored 'General case' 0 CA--C 1.514 -0.423 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.596 179.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -48.07 -33.76 8.6 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.473 0.483 . . . . 0.0 110.655 173.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.461 ' NE2' ' HB3' ' A' ' 51' ' ' PRO . 5.0 tt0 -52.74 -58.81 5.66 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.591 173.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.722 ' CD2' ' HA ' ' A' ' 38' ' ' ASN . 53.6 m-85 -54.89 -51.48 65.85 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.172 -177.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.446 ' CD1' ' CE1' ' A' ' 23' ' ' PHE . 8.7 mp -44.6 -55.92 4.79 Favored 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.619 0.724 . . . . 0.0 110.864 179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.632 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 11.8 tp10 -65.85 -55.46 16.95 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.556 -177.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 11.1 m -56.75 -43.55 80.83 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.74 0.305 . . . . 0.0 110.963 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.469 HG13 ' O ' ' A' ' 41' ' ' PHE . 58.8 mt -75.28 -32.18 25.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.222 -172.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 4.3 ptp180 -71.1 -25.08 62.45 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.112 0.482 . . . . 0.0 109.893 175.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.632 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 16.3 mmt180 -84.57 -12.74 53.51 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.693 177.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 91.35 12.24 60.07 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.173 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -90.72 166.83 12.92 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 178.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.537 HG11 HG21 ' A' ' 63' ' ' VAL . 58.0 t -114.33 117.55 42.99 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.934 -177.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HB3' ' NE2' ' A' ' 40' ' ' GLN . 18.4 Cg_exo -64.3 143.72 83.98 Favored 'Trans proline' 0 CA--C 1.533 0.439 0 C-N-CA 122.674 2.249 . . . . 0.0 111.938 176.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -70.02 -14.45 62.69 Favored 'General case' 0 C--O 1.226 -0.147 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.684 -174.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.623 ' HG2' ' CZ ' ' A' ' 41' ' ' PHE . 8.2 mp0 -62.55 -47.32 84.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.578 178.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.507 HD13 HG11 ' A' ' 14' ' ' VAL . 0.2 OUTLIER -89.08 -40.24 13.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.751 -0.658 . . . . 0.0 110.223 -179.054 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.2 tpt180 -61.43 -57.41 12.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.866 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.0 tpm_? -81.4 47.44 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.765 0.793 . . . . 0.0 109.684 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' ' 54' ' ' LEU . 39.1 tp -129.63 -51.75 1.16 Allowed 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.594 -1.185 . . . . 0.0 108.186 168.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.713 ' HB2' HG13 ' A' ' 12' ' ' VAL . . . -57.98 137.82 56.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.111 -0.95 . . . . 0.0 112.18 172.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 10' ' ' GLN . 23.9 m-70 -98.16 78.44 2.49 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.657 173.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 165.72 -33.61 0.24 Allowed Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.108 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 102.95 -15.09 55.72 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.854 -0.689 . . . . 0.0 113.4 174.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.538 ' HG2' ' OD1' ' A' ' 11' ' ' ASP . 5.6 tt0 -71.88 125.94 28.46 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 178.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.537 HG21 HG11 ' A' ' 50' ' ' VAL . 41.6 t -131.26 106.83 12.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.237 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -176.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.88 107.84 15.95 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.601 -0.272 . . . . 0.0 110.459 176.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.637 HD11 ' HB2' ' A' ' 16' ' ' LEU . 0.3 OUTLIER -106.29 131.43 53.53 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.9 0.381 . . . . 0.0 111.136 -177.316 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -118.23 143.92 46.17 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.32 178.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 61.8 mtt -109.06 134.07 52.16 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.952 0.406 . . . . 0.0 111.796 -178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -118.48 155.6 30.53 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.552 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -115.69 116.29 27.83 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 177.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.643 ' HB3' ' HB2' ' A' ' 73' ' ' GLU . 78.0 m-70 -128.84 -53.66 1.22 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.242 0.544 . . . . 0.0 109.831 178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.708 ' HA ' ' C ' ' A' ' 19' ' ' TRP . 52.9 mtp180 52.09 -85.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.589 -1.187 . . . . 0.0 114.027 174.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -71.99 -1.25 13.88 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.98 0.419 . . . . 0.0 111.473 -175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' HIS . 13.8 mt-10 -78.91 -19.45 51.8 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.453 174.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.6 t70 64.44 178.2 0.18 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.163 -172.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.608 ' HB2' HD12 ' A' ' 30' ' ' LEU . 56.9 t80 -79.09 139.4 38.1 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.466 0.65 . . . . 0.0 112.75 -165.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.3 p -171.59 110.67 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 114.6 -1.182 . . . . 0.0 110.029 176.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.721 ' HB3' ' CD ' ' A' ' 78' ' ' PRO . 22.2 ttmt -161.46 -86.21 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.878 0 CA-C-O 118.655 -0.688 . . . . 0.0 112.615 175.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.721 ' CD ' ' HB3' ' A' ' 77' ' ' LYS . 38.3 Cg_endo -64.36 -16.51 55.5 Favored 'Trans proline' 0 C--N 1.364 1.372 0 C-N-CA 122.472 2.115 . . . . 0.0 111.82 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -66.83 -44.36 81.3 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.088 175.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.47 70.14 0.87 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.746 178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . 70.46 -79.52 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 123.47 0.708 . . . . 0.0 112.235 177.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . 0.491 ' O ' ' HG2' ' A' ' 77' ' ' LYS . 72.6 m-85 -136.66 -84.81 0.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -174.422 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.7 pttp -94.56 -9.39 35.36 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 121.109 -0.237 . . . . 0.0 111.476 -174.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . 61.12 -168.72 0.17 Allowed 'General case' 0 C--O 1.237 0.421 0 O-C-N 123.82 0.7 . . . . 0.0 111.362 -177.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -166.44 140.05 4.06 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.981 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 25.0 m -76.96 -24.82 52.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.071 0.462 . . . . 0.0 110.603 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 80.24 -69.73 3.08 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.076 -0.583 . . . . 0.0 112.658 177.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.85 -37.83 85.97 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.401 0.62 . . . . 0.0 110.794 -177.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 114.45 143.44 8.27 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.642 -178.543 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -104.21 -15.32 15.54 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.367 0.603 . . . . 0.0 109.797 179.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -85.06 -50.86 7.08 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.397 176.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.8 tp 48.14 52.61 12.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 122.138 0.971 . . . . 0.0 110.461 178.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 94' ' ' SER . . . 169.82 89.44 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.459 ' HB2' ' O ' ' A' ' 93' ' ' GLY . 69.1 m 73.86 125.6 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 -163.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' A' ' 96' ' ' ALA . 10.5 m -50.98 -42.35 60.14 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 113.347 0.869 . . . . 0.0 113.347 -166.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.42 ' HA ' ' HD3' ' A' ' 97' ' ' PRO . . . 73.12 126.19 0.03 OUTLIER Pre-proline 0 C--O 1.235 0.293 0 O-C-N 123.919 0.762 . . . . 0.0 110.498 -174.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 96' ' ' ALA . 16.8 Cg_exo -65.68 159.77 46.7 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.704 2.269 . . . . 0.0 111.841 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -72.72 -97.51 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.745 -178.523 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.435 ' O ' ' HB2' ' A' ' 100' ' ' LEU . 18.7 t 43.89 -96.55 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 C-N-CA 123.162 0.585 . . . . 0.0 111.338 -177.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' VAL . 13.5 tp 175.47 -60.5 0.01 OUTLIER 'General case' 0 C--O 1.231 0.109 0 C-N-CA 123.125 0.57 . . . . 0.0 110.196 176.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 2.2 m -87.66 39.08 0.86 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.225 -172.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 88.1 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.411 -0.804 . . . . 0.0 110.818 -177.09 . . . . . . . . 0 0 . 1 stop_ save_