data_1t8c_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 1t8c _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 ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.784 0.326 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.774 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.774 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.58 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.677 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.626 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.594 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 43' ' ' LEU . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.734 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.734 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.478 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.493 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.826 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.656 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.808 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.513 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.67 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.67 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.808 HD21 HG23 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.426 ' N ' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 C--O 1.229 -0.203 0 N-CA-C 112.759 -0.136 . . . . 0.0 112.759 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.826 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.656 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.482 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.445 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.556 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.6 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.993 0.425 . . . . 0.0 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.433 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.641 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.1 m-20 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.865 0.364 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.497 HG11 ' CE3' ' A' ' 113' ' ' TRP . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.416 ' HE3' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.4 mp . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.512 0.196 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.553 HG22 ' CD1' ' A' ' 22' ' ' PHE . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.478 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.695 0.283 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.8 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.505 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.8 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.596 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.59 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.478 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.504 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB3' HD12 ' A' ' 43' ' ' LEU . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.722 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.524 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.478 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.827 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.612 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.771 HG23 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.622 ' HB2' HG22 ' A' ' 46' ' ' ILE . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.618 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.618 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.486 ' N ' HG22 ' A' ' 56' ' ' THR . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.474 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.479 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.486 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.827 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.637 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.605 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 121.06 0.457 . . . . 0.0 110.354 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.637 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.673 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.04 0.448 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.443 HG11 ' CE3' ' A' ' 113' ' ' TRP . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.561 ' HE1' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.673 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.486 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.4 mp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.506 0.193 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.509 HG21 ' CD1' ' A' ' 22' ' ' PHE . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.539 ' HD3' ' HZ3' ' A' ' 12' ' ' TRP . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.431 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.697 0.284 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.778 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.778 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.586 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.404 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.551 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.681 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.818 0.342 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.558 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.558 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.747 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.496 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.606 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.8 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.482 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.571 ' HB2' HG23 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.622 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.454 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.8 HD21 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.496 ' N ' HG22 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.493 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.507 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.192 0 CA-C-O 120.812 0.118 . . . . 0.0 112.857 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.468 ' HB2' HG22 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.431 ' HE3' ' HA ' ' A' ' 125' ' ' TRP . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.817 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.62 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.507 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.523 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 34.3 t30 . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.575 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.004 0.431 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.62 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG11 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.677 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.9 m-20 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.914 0.388 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.448 HG13 ' CE3' ' A' ' 113' ' ' TRP . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.432 ' HE1' ' HB2' ' A' ' 106' ' ' MET . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.479 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 2.5 ppt_? . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.677 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.507 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.47 0.176 . . . . 0.0 110.603 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.431 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 64' ' ' SER . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.437 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.802 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.725 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.534 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.505 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.43 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.725 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.624 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.486 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.653 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.75 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.403 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.504 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.504 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.843 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.625 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.791 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.467 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.65 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.467 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.791 HD21 HG21 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.599 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.541 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.402 ' CD1' ' HA ' ' A' ' 29' ' ' TRP . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.843 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.511 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.453 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.418 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.579 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.465 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.625 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.465 ' HA ' ' NE1' ' A' ' 79' ' ' TRP . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.658 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.41 HG12 ' CE3' ' A' ' 113' ' ' TRP . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.502 ' HE1' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.658 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.46 ' HB3' ' H ' ' A' ' 123' ' ' GLY . 6.0 mp . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.464 0.173 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.46 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.541 ' HB1' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.541 HG21 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.735 0.303 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.724 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.523 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.507 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.444 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.724 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.583 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.431 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.659 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.43 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.5 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.847 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.847 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.832 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.593 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.796 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.643 ' HB2' HG23 ' A' ' 46' ' ' ILE . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.622 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.796 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.597 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.199 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.832 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.627 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.43 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.428 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.537 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.953 0.406 . . . . 0.0 110.687 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.451 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.627 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.681 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 . . . . . 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.547 HG12 ' CE3' ' A' ' 113' ' ' TRP . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.459 ' HG2' ' O ' ' A' ' 114' ' ' ASN . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.586 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.681 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.43 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.702 HG11 HG22 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.484 ' N ' HG13 ' A' ' 126' ' ' VAL . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.509 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.509 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.731 0.3 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.491 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.743 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.583 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.695 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.42 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.742 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.475 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.509 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.847 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.646 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.807 HG23 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.501 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.638 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.638 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.807 HD22 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.598 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.522 ' N ' HG21 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.492 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.236 0 N-CA-C 112.737 -0.145 . . . . 0.0 112.737 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.847 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.646 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.531 HD11 ' N ' ' A' ' 69' ' ' ARG . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.531 ' N ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.471 ' CD1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.638 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' CG ' ' A' ' 77' ' ' PHE . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.526 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.698 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 70.8 m-20 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.516 HG13 ' CE3' ' A' ' 113' ' ' TRP . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.468 ' HG3' ' HB2' ' A' ' 114' ' ' ASN . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.548 ' HE3' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.698 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.468 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.415 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.587 0.232 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.43 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.475 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.424 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.829 0.347 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.703 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.503 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.699 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.518 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.564 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.404 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.675 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.444 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.542 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.542 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.772 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.505 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.505 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.812 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.649 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.831 HG23 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.595 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.665 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.665 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.454 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.831 HD22 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.565 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 . . . . . 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.45 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.247 0 N-CA-C 112.902 -0.079 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.812 ' HA ' HG21 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.649 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.668 ' N ' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.56 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.568 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.649 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.516 HG23 ' CG ' ' A' ' 77' ' ' PHE . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.478 ' HB3' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.702 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 . . . . . 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.462 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 6.5 ptp180 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.702 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.445 HD22 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.436 0.16 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.694 HG13 HG23 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 126' ' ' VAL . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.406 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.62 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.427 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.797 0.332 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.745 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.745 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.585 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.704 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.674 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.491 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.769 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.769 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.426 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.494 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.754 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.634 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.545 HG23 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.499 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.433 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.566 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.433 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.566 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.611 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.612 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.622 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.473 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.754 ' HA ' HG22 ' A' ' 44' ' ' VAL . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.634 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.531 ' HB2' HG13 ' A' ' 66' ' ' ILE . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.491 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.549 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 3.0 t30 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.464 ' CD1' ' HG ' ' A' ' 68' ' ' LEU . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.605 HG12 ' CA ' ' A' ' 67' ' ' GLY . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.528 ' CG2' HD22 ' A' ' 68' ' ' LEU . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.472 ' N ' HG11 ' A' ' 85' ' ' VAL . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.4 ' HB3' HG12 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.566 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 1.2 t-20 . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.982 0.42 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.464 HG13 ' CE3' ' A' ' 113' ' ' TRP . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.453 ' HE1' ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.622 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 106' ' ' MET . . . . . . . . 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.473 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.7 mp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.492 HG11 ' CG2' ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.426 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.474 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.694 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.516 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.5 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.694 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.632 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.503 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.637 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.637 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.652 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.454 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.55 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.43 ' HB1' HD12 ' A' ' 43' ' ' LEU . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.502 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.502 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.748 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.449 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.499 ' HB2' HG23 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.621 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.621 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.748 HD21 HG21 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.516 -0.233 . . . . 0.0 112.516 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.465 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.657 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.467 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.454 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.465 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 2.1 m120 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.628 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.448 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.647 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.68 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.894 0.378 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.543 HG13 ' CE3' ' A' ' 113' ' ' TRP . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.451 ' HB2' ' CD2' ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.558 ' HB2' ' O ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.558 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.68 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.465 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.9 mp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.47 0.176 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.465 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.545 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.474 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.78 0.324 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.823 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.568 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.2 t-20 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.514 ' HA2' ' HZ2' ' A' ' 11' ' ' LYS . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.715 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.715 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.836 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.593 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.765 HG22 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.643 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.432 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.765 HD21 HG22 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.568 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.497 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.828 ' HB2' HG22 ' A' ' 126' ' ' VAL . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.836 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.635 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.512 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.601 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.635 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.665 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 87.7 m-20 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' CE3' ' A' ' 113' ' ' TRP . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.617 ' HE2' ' HB2' ' A' ' 114' ' ' ASN . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.467 ' HD2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.665 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.617 ' HB2' ' HE2' ' A' ' 106' ' ' MET . 15.3 m-20 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 5.2 mp . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.583 0.23 . . . . 0.0 110.734 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.582 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.828 HG22 ' HB2' ' A' ' 64' ' ' SER . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.746 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.746 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.699 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.709 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.652 0.263 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.472 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.654 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.534 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.834 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.679 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.704 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.426 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.709 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.611 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.483 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.45 -0.375 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.55 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.474 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.834 ' HA ' HG22 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.679 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.643 HD21 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.643 ' N ' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.538 ' CD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.645 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.53 HG21 ' CG ' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 85' ' ' VAL . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.508 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.712 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 57.4 m-20 . . . . . 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 23.9 m . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 115' ' ' ASP . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.55 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.712 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.517 ' HA ' HG23 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.474 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 6.5 mp . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.455 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.549 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.429 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.415 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.666 0.27 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.749 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.493 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.591 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.749 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.577 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.628 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.799 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.41 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.529 ' HB2' HG23 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.6 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.6 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.463 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.799 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.556 ' N ' HG23 ' A' ' 56' ' ' THR . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.591 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.507 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.241 0 CA-C-O 120.873 0.152 . . . . 0.0 112.974 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.401 ' HB2' HG22 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.455 ' NE1' HD11 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.837 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.648 ' CA ' HG11 ' A' ' 80' ' ' VAL . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.584 ' HG ' HG22 ' A' ' 105' ' ' VAL . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.527 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.403 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.446 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.648 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.403 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.527 HG21 ' CG ' ' A' ' 77' ' ' PHE . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.425 ' N ' HG13 ' A' ' 85' ' ' VAL . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.423 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.668 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 62.4 m-20 . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.584 HG22 ' HG ' ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.403 ' HB3' HD13 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.458 ' HE3' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' ' 112' ' ' ARG . 3.6 ptp180 . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.668 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.507 HD23 ' HA3' ' A' ' 63' ' ' GLY . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.414 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.467 HG11 ' CG2' ' A' ' 44' ' ' VAL . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.513 ' C ' ' HD3' ' A' ' 9' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.056 0 CA-C-O 120.616 0.246 . . . . 0.0 111.087 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.577 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.42 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.708 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.577 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.4 t-20 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.831 0.348 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.546 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.471 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.546 ' HB3' ' CA ' ' A' ' 67' ' ' GLY . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.779 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.603 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.78 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.438 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.494 ' CB ' HG22 ' A' ' 46' ' ' ILE . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.625 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.78 HD21 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.528 ' N ' HG21 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.42 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.555 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.441 ' HE3' ' HA ' ' A' ' 125' ' ' TRP . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.779 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.61 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.494 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 t30 . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.028 0.442 . . . . 0.0 110.589 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.433 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.61 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.708 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 83.9 m-20 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.011 0.434 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.492 HG11 ' CE3' ' A' ' 113' ' ' TRP . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.527 ' HE3' ' HB2' ' A' ' 114' ' ' ASN . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.555 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.492 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.708 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.527 ' HB2' ' HE3' ' A' ' 106' ' ' MET . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.408 ' HB3' ' H ' ' A' ' 123' ' ' GLY . 5.4 mp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.451 0.167 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.408 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.441 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.744 HG13 HG23 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.409 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.444 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.646 0.26 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.534 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.593 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.647 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.553 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.79 0.329 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.472 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.876 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.876 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.713 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.503 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.503 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.799 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.571 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.53 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.532 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.71 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.426 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.573 ' N ' HG22 ' A' ' 56' ' ' THR . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.534 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.701 -0.159 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.77 ' HB2' HG22 ' A' ' 126' ' ' VAL . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.799 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.624 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.472 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.458 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.624 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.571 HG21 ' CG ' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.71 HD22 ' HG2' ' A' ' 52' ' ' GLN . 52.2 m-20 . . . . . 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.927 0.394 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.449 ' HE3' ' HG ' ' A' ' 122' ' ' LEU . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.547 ' HE1' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' HE3' ' A' ' 106' ' ' MET . 5.8 mp . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.77 HG22 ' HB2' ' A' ' 64' ' ' SER . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.44 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.713 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.706 0.289 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.779 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.5 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.523 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.779 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.674 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.513 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.554 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.554 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.761 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.829 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.652 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.649 HG23 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.507 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.508 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.649 ' HB2' HG23 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.66 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.66 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.523 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 . . . . . 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.476 ' HA2' ' SD ' ' A' ' 107' ' ' MET . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.92 -0.072 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.439 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.491 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.829 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.652 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 77' ' ' PHE . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.513 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.542 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.458 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.643 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' CG ' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.568 HD22 ' HG2' ' A' ' 52' ' ' GLN . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.541 HG13 ' CE3' ' A' ' 113' ' ' TRP . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.432 ' HB2' ' CD2' ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.503 ' HB2' ' HE3' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.589 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.491 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.2 mp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.69 0.281 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.583 HG22 ' CD1' ' A' ' 22' ' ' PHE . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.684 0.278 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.518 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.454 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.471 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.592 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.696 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.661 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.744 0.306 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.462 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.527 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.702 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.497 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.506 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.827 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.674 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.712 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.54 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.515 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.661 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.638 HG23 ' HE2' ' A' ' 107' ' ' MET . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.471 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.827 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.674 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.644 HD22 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.644 ' N ' HD22 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.528 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.538 ' HB2' ' CD2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.528 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.651 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.506 HG23 ' CG ' ' A' ' 77' ' ' PHE . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.487 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.733 HD22 ' HG2' ' A' ' 52' ' ' GLN . 6.3 m-20 . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.441 HG21 ' CD1' ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.638 ' HE2' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.518 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.61 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 4.5 mp . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.78 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.71 HG13 HG22 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.495 ' N ' HG12 ' A' ' 126' ' ' VAL . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.448 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.566 ' HB3' ' HB2' ' A' ' 19' ' ' CYS . . . . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.71 0.291 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.534 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.688 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.621 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.481 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.673 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.755 0.312 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.556 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.679 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.679 ' N ' ' HG3' ' A' ' 42' ' ' GLN . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.799 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.562 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.75 HG22 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . 0.642 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.449 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.636 ' HB2' HG21 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.674 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.546 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.449 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.75 HD23 HG22 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.539 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . . . . . . 0 CA--C 1.517 0.186 0 N-CA-C 112.824 -0.111 . . . . 0.0 112.824 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.767 ' HB2' HG23 ' A' ' 126' ' ' VAL . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.676 ' NE1' HD12 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.799 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.624 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.732 HD11 HD12 ' A' ' 66' ' ' ILE . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.56 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.6 ' CD2' HG21 ' A' ' 105' ' ' VAL . 3.2 m-85 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.642 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.624 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.522 ' HA ' ' NE1' ' A' ' 79' ' ' TRP . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.412 ' HB3' ' CG1' ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.741 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.6 HG21 ' CD2' ' A' ' 77' ' ' PHE . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.439 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.52 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.484 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.741 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.676 HD12 ' NE1' ' A' ' 65' ' ' TRP . 2.0 mp . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.432 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 64' ' ' SER . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.406 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.438 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.65 0.262 . . . . 0.0 111.371 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.733 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.622 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.733 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.557 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.79 0.329 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.504 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.479 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.565 HD23 ' HA2' ' A' ' 67' ' ' GLY . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.663 ' N ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.8 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' CB ' HG23 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.627 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.627 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.8 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.501 ' N ' HG23 ' A' ' 56' ' ' THR . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.58 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.17 0 CA-C-O 120.814 0.119 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.446 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.817 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.713 ' CA ' HG11 ' A' ' 80' ' ' VAL . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.613 HD23 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.613 ' CD1' HD23 ' A' ' 68' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.567 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.596 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.713 HG11 ' CA ' ' A' ' 67' ' ' GLY . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.567 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.422 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.579 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.596 HG13 ' CE3' ' A' ' 113' ' ' TRP . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.51 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.517 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 1.4 ppt_? . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.596 ' CE3' HG13 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.404 HD21 ' HE1' ' A' ' 106' ' ' MET . 3.7 m-20 -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.58 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.2 mp . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.439 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.702 HG13 HG22 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . 0.415 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.764 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.54 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.513 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.764 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.584 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.5 t-20 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.407 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.646 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.648 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.723 0.297 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.568 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.532 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.59 HD21 ' HA2' ' A' ' 67' ' ' GLY . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.87 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.657 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.774 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.446 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.674 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.774 HD21 HG23 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.441 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.496 ' HA2' ' SD ' ' A' ' 107' ' ' MET . . . . . . . . 0 CA--C 1.517 0.207 0 N-CA-C 112.942 -0.063 . . . . 0.0 112.942 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.461 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.645 ' NE1' HD12 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.87 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.686 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.722 HD11 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.615 ' HE1' ' HE1' ' A' ' 79' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.572 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.615 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.686 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.572 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.572 HG23 ' CD1' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.401 ' HB3' ' CE2' ' A' ' 77' ' ' PHE . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.604 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 115' ' ' ASP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' MET . . . . . 0.442 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.496 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . 0.403 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 1.1 ptp180 . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.623 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.452 ' HA ' HG23 ' A' ' 105' ' ' VAL . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.645 HD12 ' NE1' ' A' ' 65' ' ' TRP . 2.6 mp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . 0.473 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.713 HG13 HG22 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.416 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.407 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.592 HG23 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.581 0.229 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.78 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.491 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.534 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' TRP . . . . . 0.78 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.607 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.401 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.673 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.687 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.497 ' HA2' ' HZ2' ' A' ' 11' ' ' LYS . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.593 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.421 ' HB3' ' HE2' ' A' ' 39' ' ' MET . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.421 ' HE2' ' HB3' ' A' ' 38' ' ' ASP . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLN . . . . . 0.5 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.878 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.656 ' N ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.748 HG21 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.506 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.5 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.446 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.748 ' HB2' HG21 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.649 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.446 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.687 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . 0.634 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.534 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.449 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.454 -0.258 . . . . 0.0 112.454 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.49 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.434 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.878 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.734 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 66' ' ' ILE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASN . . . . . 0.63 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 4.8 t-20 . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.734 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.412 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.531 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' O ' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASN . . . . . 0.667 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 52.9 m-20 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.976 0.417 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.571 HG11 ' CE3' ' A' ' 113' ' ' TRP . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' MET . . . . . 0.518 ' HE3' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TRP . . . . . 0.667 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.451 ' HB3' ' H ' ' A' ' 123' ' ' GLY . 6.1 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.458 0.17 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.532 HG23 ' CD1' ' A' ' 22' ' ' PHE . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . 0.439 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ALA . . . . . 0.592 ' HA ' HG23 ' A' ' 7' ' ' THR . . . . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.791 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.67 54.82 0.27 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -78.39 147.05 34.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.536 HG12 ' HB2' ' A' ' 131' ' ' ALA . 26.4 m -72.85 -171.99 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.046 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 133' ' ' CYS . 94.5 m -102.44 -92.56 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -177.73 74.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.793 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 132' ' ' THR . 2.9 t -89.37 3.53 51.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.974 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.774 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.413 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.774 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.519 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.58 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.416 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.677 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.626 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -114.37 160.51 19.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.49 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -174.23 -164.83 29.85 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.59 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.03 87.51 0.37 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.773 0.321 . . . . 0.0 110.799 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.453 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 9.4 mmtt -162.95 -142.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.453 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -115.43 -176.95 3.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.445 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.594 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.45 ' HB1' HD11 ' A' ' 43' ' ' LEU . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.594 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.734 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.734 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.478 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.493 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.826 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.656 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.808 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.513 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.468 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.67 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.67 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.468 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.808 HD21 HG23 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.426 ' N ' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.413 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 -64.42 -32.91 74.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.33 100.23 3.12 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.003 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -60.06 -71.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.5 p-80 -130.32 16.08 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.854 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 10.8 p -139.56 114.97 9.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -56.99 175.22 1.47 Allowed Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.759 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.48 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.826 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.656 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.482 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.445 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.469 HD22 ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -86.98 149.93 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.14 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.086 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -110.2 -75.15 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.805 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.469 ' N ' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -152.96 -76.99 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.791 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.99 7.62 12.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.048 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.84 -130.15 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.603 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.33 143.39 50.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.8 0.333 . . . . 0.0 110.755 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.556 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -81.78 124.39 29.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.488 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.433 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.641 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.47 HG22 ' HB2' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.411 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.1 m-20 -139.97 -14.78 1.03 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.519 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -35.07 112.19 0.14 Allowed 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -178.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' A' ' 90' ' ' TRP . . . -28.89 115.3 0.28 Allowed Pre-proline 0 N--CA 1.464 0.272 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.938 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -57.63 -66.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.634 2.223 . . . . 0.0 112.311 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -99.79 85.37 0.64 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.493 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -120.82 81.75 34.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.678 0.275 . . . . 0.0 110.956 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.22 142.61 87.07 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.572 2.182 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.6 40.86 31.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.959 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.07 25.4 0.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.885 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -136.31 -17.5 1.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -106.92 83.97 1.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.966 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -166.18 -33.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 155.59 164.03 12.76 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.387 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.412 ' HA ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.8 131.92 11.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.729 0.3 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.427 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 3.3 t70 -169.02 -29.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 140.11 36.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.452 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.497 HG11 ' CE3' ' A' ' 113' ' ' TRP . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.416 ' HE3' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -124.12 129.68 51.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 168.86 -160.31 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.659 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.67 -109.76 2.97 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.922 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.9 m -81.69 37.17 0.46 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.696 0.284 . . . . 0.0 111.224 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.465 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 57.94 30.18 63.02 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.495 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -133.13 -146.14 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.519 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.412 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -156.25 161.99 40.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -40.9 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.688 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 32.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.759 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -95.5 -10.15 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.718 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -61.65 113.82 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.18 92.33 8.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.062 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.48 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.4 mp -85.34 -159.18 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.503 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.544 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.49 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.553 HG22 ' CD1' ' A' ' 22' ' ' PHE . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.478 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.438 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.536 ' HB2' HG12 ' A' ' 4' ' ' VAL . . . -45.06 124.51 4.59 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.407 ' O ' ' HB ' ' A' ' 7' ' ' THR . 21.5 p -131.75 -169.0 2.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.619 ' HA ' ' HB2' ' A' ' 5' ' ' CYS . 84.0 m -100.64 -172.34 2.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.2 p -141.51 97.61 6.68 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . 0.812 ' HG2' ' HB2' ' A' ' 138' ' ' SER . 47.2 Cg_endo -68.7 154.45 71.31 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.495 2.13 . . . . 0.0 112.253 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.84 -8.63 24.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.555 2.17 . . . . 0.0 112.323 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.06 -42.48 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.114 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.812 ' HB2' ' HG2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -74.0 -177.58 2.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 123.08 21.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.877 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -134.98 -102.43 0.71 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.499 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.0 t -124.17 -65.17 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.25 35.57 26.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.238 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.922 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 p . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.796 0.331 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.23 -150.59 22.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.468 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -72.7 151.12 42.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.805 0.336 . . . . 0.0 110.849 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.577 HG22 ' H ' ' A' ' 5' ' ' CYS . 0.2 OUTLIER -126.44 -58.43 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.148 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.577 ' H ' HG22 ' A' ' 4' ' ' VAL . 2.4 m 55.01 47.48 22.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -168.21 66.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.895 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -91.1 2.8 56.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.898 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.8 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.505 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.474 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.8 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.596 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.445 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.59 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.546 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm -121.27 153.92 37.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.425 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 161.41 126.81 0.84 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.528 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.2 m -93.63 115.8 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.769 0.319 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -167.18 -143.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.818 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.447 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 30.1 mt-30 -116.04 175.86 5.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.478 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.504 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.417 ' CG ' ' HG2' ' A' ' 27' ' ' LYS . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.4 ' HB3' HD12 ' A' ' 43' ' ' LEU . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.722 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.722 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.524 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.478 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.488 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.827 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.612 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.771 HG23 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.572 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.622 ' HB2' HG22 ' A' ' 46' ' ' ILE . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.618 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.618 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.771 HD23 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.587 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.486 ' N ' HG22 ' A' ' 56' ' ' THR . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.474 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 -63.95 -33.47 75.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.528 ' HB1' ' H ' ' A' ' 63' ' ' GLY . . . -85.02 103.42 14.03 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.1 m -80.09 88.07 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.024 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.0 m80 54.97 30.31 13.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.59 -41.03 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.874 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.528 ' H ' ' HB1' ' A' ' 59' ' ' ALA . . . 85.01 146.93 8.54 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.48 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.486 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.827 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.637 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.457 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.478 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.551 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 2.9 m120 -64.13 155.54 31.21 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.11 -22.17 58.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.765 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.33 -77.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.822 179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.431 HD21 ' HA2' ' A' ' 101' ' ' GLY . 0.7 OUTLIER -149.93 -78.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.858 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' H ' ' HG2' ' A' ' 74' ' ' LYS . 6.2 pttp -101.47 7.81 42.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.89 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.27 -113.25 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.707 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -127.29 137.21 52.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.989 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.605 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.2 OUTLIER -74.83 127.32 32.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.354 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.422 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.637 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.489 HG21 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.468 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.673 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 -140.45 -20.13 0.85 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.683 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.96 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.131 0.491 . . . . 0.0 111.499 -179.241 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 62.62 149.87 0.1 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.395 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.15 -17.03 45.38 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.511 2.141 . . . . 0.0 112.292 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 145.96 86.22 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.446 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.44 112.11 1.37 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.607 0.241 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.0 110.38 2.59 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.525 2.15 . . . . 0.0 112.305 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.79 131.17 42.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.1 p -105.36 14.5 28.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 13.0 ptt-85 -143.51 41.87 1.48 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.96 -73.83 0.35 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.956 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.64 45.24 25.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.975 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.431 ' HA2' HD21 ' A' ' 73' ' ' LEU . . . -177.77 -103.7 0.17 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.524 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 6.6 mt-10 60.5 96.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 0.0 111.131 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.551 ' HA ' ' HB2' ' A' ' 70' ' ' ASN . 33.9 t70 -137.61 -23.1 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.794 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.9 144.62 31.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.555 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.443 HG11 ' CE3' ' A' ' 113' ' ' TRP . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.561 ' HE1' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -124.75 130.72 52.95 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 108' ' ' ARG . 0.4 OUTLIER -109.1 165.85 11.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.222 -179.549 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.94 -13.85 57.81 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.516 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -52.95 -31.61 41.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.835 0.35 . . . . 0.0 110.781 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.468 ' HA2' ' CG2' ' A' ' 56' ' ' THR . . . 118.12 21.44 4.13 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.709 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -163.17 -164.68 0.98 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.673 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.683 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.78 39.95 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 103' ' ' ASP . 27.9 t80 -41.31 -78.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.696 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.32 32.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.718 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -95.24 -10.5 30.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.704 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.435 HH11 ' HD3' ' A' ' 120' ' ' ARG . 20.4 mmt180 -63.4 112.31 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.11 93.94 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.486 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.4 mp -85.23 -162.96 0.77 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.544 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.546 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.509 HG21 ' CD1' ' A' ' 22' ' ' PHE . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.443 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.539 ' HD3' ' HZ3' ' A' ' 12' ' ' TRP . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.431 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.07 -167.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.14 -164.11 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.003 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 57.67 37.09 27.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.883 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 p -87.6 137.39 32.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.65 123.62 10.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.53 2.153 . . . . 0.0 112.292 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -55.99 111.37 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.589 2.193 . . . . 0.0 112.23 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.47 -35.11 15.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.8 p -152.65 -60.36 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.23 115.86 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.18 126.78 8.44 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.445 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 127.86 34.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.873 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.29 96.16 2.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.131 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.891 179.997 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.805 0.336 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.91 -97.34 0.24 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.492 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -81.83 154.42 25.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.6 m -70.63 161.87 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.108 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 55.96 29.84 14.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -171.26 52.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t -91.89 9.66 31.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.778 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.778 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.586 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.404 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.551 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.681 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt -134.07 153.24 51.93 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.9 -126.86 8.15 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.823 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.763 HG21 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.0 -162.74 0.23 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.704 0.288 . . . . 0.0 111.177 -179.831 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.84 -78.21 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.365 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -121.15 -171.85 2.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.276 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.558 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.763 ' HB3' HG21 ' A' ' 26' ' ' THR . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.558 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.747 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.496 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.496 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.606 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.8 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.482 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.571 ' HB2' HG23 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.622 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.454 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.8 HD21 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.496 ' N ' HG22 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.493 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -66.06 -32.01 73.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.51 96.32 9.1 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.01 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -60.67 -77.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.885 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -118.49 9.33 12.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.455 ' HB ' ' C ' ' A' ' 123' ' ' GLY . 26.6 p -126.44 101.69 6.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.507 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -52.69 169.48 0.71 Allowed Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.857 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.468 ' HB2' HG22 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.431 ' HE3' ' HA ' ' A' ' 125' ' ' TRP . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.817 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.62 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.507 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.754 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 34.3 t30 -89.31 148.36 23.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.3 mt -47.06 -82.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.459 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -112.62 -78.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.077 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.545 HD13 ' HA ' ' A' ' 100' ' ' GLN . 0.3 OUTLIER -146.43 -56.39 0.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.811 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -101.2 7.46 43.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.39 -135.39 0.14 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.46 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -123.29 133.16 54.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.575 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER -72.0 120.52 17.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.351 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.408 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.62 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.5 HG21 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG11 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.432 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.677 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.9 m-20 -140.54 -13.16 1.0 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.562 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -40.16 107.91 0.08 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.057 0.456 . . . . 0.0 111.319 -179.178 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -48.76 113.17 2.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.276 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.53 -12.34 20.56 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.731 2.287 . . . . 0.0 112.379 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.89 19.45 16.38 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.567 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.77 72.15 9.65 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 110.953 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.32 110.71 3.12 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.539 2.159 . . . . 0.0 112.422 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.45 144.94 32.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.82 169.68 22.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.957 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 58.33 -172.66 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.056 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.1 85.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.064 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.545 ' HA ' HD13 ' A' ' 73' ' ' LEU . 4.9 mt-30 -79.11 133.21 36.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 -134.26 2.7 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.462 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -167.87 0.89 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.749 0.309 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.754 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 0.3 OUTLIER -164.48 112.33 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.989 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m -143.34 152.18 41.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.359 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.448 HG13 ' CE3' ' A' ' 113' ' ' TRP . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.432 ' HE1' ' HB2' ' A' ' 106' ' ' MET . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -124.78 129.52 50.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.64 -162.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.6 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.38 -111.21 3.97 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.034 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.1 m -80.66 39.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.644 0.259 . . . . 0.0 111.335 -179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.461 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 56.7 30.2 59.14 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.415 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.479 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 2.5 ppt_? -133.77 -146.93 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.677 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.562 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.488 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -144.28 161.96 37.6 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.471 ' HD2' HD23 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -74.47 28.63 0.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.454 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.488 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER 68.69 20.25 8.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.601 179.517 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.457 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 0.7 OUTLIER -92.74 -6.43 49.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.576 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -83.26 167.41 17.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.04 118.35 15.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.987 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.507 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp -94.22 -143.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.455 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.606 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.431 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.468 HG22 ' HB2' ' A' ' 64' ' ' SER . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.437 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.53 -178.41 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 p -94.47 24.16 4.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m -98.2 30.07 3.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 81.8 p -75.19 120.18 80.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.38 115.43 2.44 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.528 2.152 . . . . 0.0 112.288 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 109.24 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.572 2.181 . . . . 0.0 112.346 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.29 117.59 13.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.063 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.52 -37.47 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -136.67 -28.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.11 123.13 12.1 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.451 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.45 125.56 27.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.827 0.346 . . . . 0.0 110.892 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.65 -40.03 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.146 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.878 179.989 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.835 0.35 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.08 -97.63 1.21 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -72.29 151.95 42.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.775 0.321 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 t -72.98 143.42 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.172 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.476 ' HB2' ' HB3' ' A' ' 133' ' ' CYS . 48.7 t -164.26 65.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.42 57.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t -88.08 1.87 53.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.725 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.534 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.505 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.43 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.725 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.514 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.624 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.486 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.439 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.653 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt -126.46 162.81 24.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.514 ' HA3' ' CZ2' ' A' ' 125' ' ' TRP . . . 163.66 -145.46 10.5 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.631 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.37 107.71 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.807 0.337 . . . . 0.0 111.097 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -166.12 -144.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.465 ' H ' ' HB2' ' A' ' 27' ' ' LYS . 1.6 mt-30 -121.11 -178.18 3.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.453 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.563 ' HB3' ' HD3' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.75 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.403 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.504 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.504 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.843 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.625 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.791 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.467 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.65 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.65 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.467 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.791 HD21 HG21 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.599 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 -65.37 -31.66 72.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -88.43 113.8 24.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.067 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -79.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -140.58 31.36 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.951 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.6 p -112.2 -53.68 2.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.541 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . 106.06 158.23 22.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.463 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.402 ' CD1' ' HA ' ' A' ' 29' ' ' TRP . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.843 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.625 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.511 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.453 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.418 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.09 156.67 17.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.5 80.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.38 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.83 29.68 0.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -76.32 -18.62 58.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.327 -179.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 105.59 -4.68 40.08 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.569 -0.824 . . . . 0.0 113.051 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.01 123.83 47.36 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.892 0.346 . . . . 0.0 110.375 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.579 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER -100.0 130.77 46.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 -179.335 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.465 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.625 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.465 ' HA ' ' NE1' ' A' ' 79' ' ' TRP . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.456 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.658 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 -140.79 -12.58 0.98 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.518 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -36.92 109.95 0.11 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.986 0.422 . . . . 0.0 111.152 -179.193 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -41.38 128.86 2.23 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.628 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.97 -33.73 1.42 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.683 2.255 . . . . 0.0 112.346 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -88.82 31.14 5.09 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.539 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.88 81.55 15.75 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.57 127.84 27.59 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.571 2.181 . . . . 0.0 112.342 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.7 p -73.94 128.53 35.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.858 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.05 6.24 45.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.907 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.2 OUTLIER 56.7 86.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.037 179.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.8 m -117.37 -166.51 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -86.81 -175.2 5.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.827 179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 122.61 -148.83 16.94 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.579 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.623 ' H ' ' HB2' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -142.26 -88.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.657 0.265 . . . . 0.0 111.044 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.18 103.51 0.87 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.922 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p -164.35 147.07 9.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.41 HG12 ' CE3' ' A' ' 113' ' ' TRP . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.502 ' HE1' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -125.3 129.93 50.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 108' ' ' ARG . 0.0 OUTLIER 171.76 -165.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.88 -179.865 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.73 -133.34 19.01 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.909 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.466 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 70.4 m -53.91 -24.8 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.74 0.305 . . . . 0.0 111.163 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.559 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 127.71 27.33 0.96 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.429 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -129.51 -148.45 0.37 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 -179.888 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.658 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.453 ' HB3' HH12 ' A' ' 120' ' ' ARG . 3.9 m120 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.518 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.7 39.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -44.32 -77.26 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.571 179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.623 ' HB2' ' H ' ' A' ' 102' ' ' GLU . 0.1 OUTLIER 174.18 32.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.734 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -113.71 56.55 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.453 HH12 ' HB3' ' A' ' 114' ' ' ASN . 0.8 OUTLIER -126.35 -39.25 2.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.714 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.87 99.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.101 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.46 ' HB3' ' H ' ' A' ' 123' ' ' GLY . 6.0 mp -85.28 -153.62 0.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.66 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.46 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.541 ' HB1' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.514 ' CZ2' ' HA3' ' A' ' 25' ' ' GLY . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.541 HG21 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -51.87 179.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.05 5.95 50.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.133 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.476 ' HB3' ' HB2' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -130.1 148.53 51.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.3 135.13 88.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.06 146.17 51.51 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.605 2.203 . . . . 0.0 112.255 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.44 99.91 0.74 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.526 2.15 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.07 113.38 10.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.131 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.9 t -118.4 -17.62 9.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 59.34 -89.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.101 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 112.02 -25.78 12.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.451 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.76 151.55 39.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 0.0 110.874 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -69.96 94.24 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.098 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.061 179.969 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.84 0.353 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.27 112.76 0.84 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.564 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.16 147.72 52.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -99.49 -75.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.113 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 53.3 45.95 27.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.956 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -169.11 84.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.416 ' HB ' ' HB ' ' A' ' 132' ' ' THR . 1.3 t -115.06 0.61 13.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.842 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.724 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.523 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.507 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.444 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.724 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.583 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.431 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.659 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.588 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt -140.85 153.03 45.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.72 94.36 0.64 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.722 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.474 ' HG1' ' HB3' ' A' ' 125' ' ' TRP . 0.1 OUTLIER -155.8 -156.99 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.703 0.287 . . . . 0.0 110.805 179.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HB2' ' CG ' ' A' ' 31' ' ' HIS . 7.5 mmtp -112.98 -95.19 0.45 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.247 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.13 -167.78 1.56 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.43 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.5 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.474 ' CG ' ' HB2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.847 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.45 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.847 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.832 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.593 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.796 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.643 ' HB2' HG23 ' A' ' 46' ' ' ILE . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.622 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.796 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.597 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -65.51 -32.16 73.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.83 99.03 6.55 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.023 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.5 m -63.07 -74.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 13.18 9.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.482 ' HG1' ' HD2' ' A' ' 24' ' ' LYS . 18.3 p -134.06 106.57 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.516 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -55.16 168.78 2.12 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.832 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.627 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.49 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.43 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.54 ' OD1' ' HA ' ' A' ' 103' ' ' ASP . 0.1 OUTLIER -84.23 154.59 22.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -71.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.229 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.62 84.02 2.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.392 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 5.6 mp 56.55 -89.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.35 7.43 14.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.636 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -164.71 3.28 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.388 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -88.32 132.5 34.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.844 0.354 . . . . 0.0 110.203 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.537 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -74.69 120.27 20.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.687 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.451 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.627 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.478 HG22 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.45 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.681 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 -140.41 -12.43 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -39.21 105.52 0.04 OUTLIER 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 111.031 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.95 124.04 1.6 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.592 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -83.76 -7.93 10.36 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.74 2.293 . . . . 0.0 112.435 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.96 15.59 31.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.622 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -137.74 72.43 49.05 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.776 0.322 . . . . 0.0 110.984 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -56.7 112.56 1.13 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.147 . . . . 0.0 112.277 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.01 122.76 21.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.4 m -130.49 -56.32 1.08 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.52 97.12 4.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 84.4 p -150.86 -171.88 4.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 -68.09 -22.13 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.954 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.91 -152.03 19.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.529 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 3.0 pt-20 -168.68 92.27 0.29 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.782 0.325 . . . . 0.0 110.876 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.54 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 36.8 t70 -116.04 -8.07 11.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.21 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m -149.26 151.9 35.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.547 HG12 ' CE3' ' A' ' 113' ' ' TRP . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.459 ' HG2' ' O ' ' A' ' 114' ' ' ASN . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.408 ' O ' ' HB2' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -124.76 129.07 49.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.408 ' HB2' ' O ' ' A' ' 107' ' ' MET . 0.2 OUTLIER 166.3 170.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 -179.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.431 ' O ' ' HB2' ' A' ' 110' ' ' SER . . . 65.1 120.89 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.565 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 1.1 m 69.19 -71.85 0.11 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.761 0.315 . . . . 0.0 110.983 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.539 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 160.02 30.44 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.797 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.586 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -137.08 -149.94 0.34 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.681 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.459 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.505 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -157.42 161.2 38.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.529 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 1.5 t80 -50.76 143.64 9.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.681 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -81.85 71.65 8.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.98 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.89 53.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.164 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.2 93.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.272 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -131.65 -12.03 3.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.451 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.43 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp -115.26 -162.29 0.82 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.474 ' HB3' ' HG1' ' A' ' 26' ' ' THR . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.702 HG11 HG22 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.484 ' N ' HG13 ' A' ' 126' ' ' VAL . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.509 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.509 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.55 154.46 0.45 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.416 ' HB ' ' HB ' ' A' ' 7' ' ' THR . 49.6 m -94.62 90.81 6.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.907 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 7.5 t -139.91 18.57 2.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.1 m 56.17 73.91 0.77 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.008 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . 0.546 ' HB2' ' HD3' ' A' ' 136' ' ' PRO . 74.8 Cg_exo -48.73 -47.91 19.43 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.712 2.275 . . . . 0.0 113.299 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' A' ' 135' ' ' PRO . 40.1 Cg_exo -57.55 104.44 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.055 1.837 . . . . 0.0 112.285 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.04 107.21 3.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.071 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.61 172.25 5.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.917 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 127.68 32.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.908 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.3 122.37 15.13 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.1 p -70.0 134.98 48.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.7 -67.9 0.77 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.001 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.799 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.61 132.08 24.48 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -114.87 10.69 16.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 0.0 110.963 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.746 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 2.8 t -117.04 -21.1 5.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.022 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 1.8 m -61.7 107.76 0.88 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.4 29.71 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.903 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -89.84 5.54 45.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.491 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.743 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.583 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.695 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.475 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.619 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm -116.3 159.07 22.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.29 138.05 2.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.568 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.7 p -77.2 -129.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.488 0.185 . . . . 0.0 110.761 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 15.6 mmtt 66.78 -163.81 0.23 Allowed 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 111.065 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -112.71 -167.9 1.25 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.491 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.491 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.42 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.742 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.742 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.475 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.509 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.847 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.646 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.807 HG23 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.501 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.638 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.638 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.807 HD22 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.598 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.522 ' N ' HG21 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.492 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 -66.93 -31.2 71.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -77.36 98.81 5.35 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.967 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 m -59.06 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.959 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -119.78 11.2 11.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.511 HG21 ' HA3' ' A' ' 123' ' ' GLY . 9.5 p -133.57 113.75 12.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.491 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -56.52 172.31 2.06 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.737 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.847 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.646 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.531 HD11 ' N ' ' A' ' 69' ' ' ARG . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.531 ' N ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.05 140.15 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.89 131.69 44.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.885 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.07 -90.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.039 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.09 -48.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttt -101.35 7.67 42.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.023 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.01 -135.27 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.567 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -122.71 142.99 50.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.849 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.38 124.41 24.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.471 ' CD1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.638 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.555 HG21 ' CG ' ' A' ' 77' ' ' PHE . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.526 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.698 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 70.8 m-20 -133.09 -6.67 3.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.534 ' C ' ' O ' ' A' ' 89' ' ' ASN . 27.0 m0 -12.48 108.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.631 0.582 . . . . 0.0 111.762 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.633 ' HB2' ' HE ' ' A' ' 112' ' ' ARG . . . -53.0 111.24 2.49 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.199 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.526 ' HD2' ' CZ ' ' A' ' 112' ' ' ARG . 35.8 Cg_exo -61.38 -30.08 86.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.652 2.234 . . . . 0.0 112.249 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.12 28.32 5.66 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -138.92 80.01 25.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.737 0.304 . . . . 0.0 110.831 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.42 118.78 5.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.678 2.252 . . . . 0.0 112.277 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.2 p -70.36 128.46 36.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.04 149.36 21.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.886 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' A' ' 98' ' ' ARG . 4.0 ttt180 -76.8 115.2 16.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.52 -168.52 2.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.852 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -143.97 146.84 33.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.05 -97.56 0.12 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.634 ' H ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -120.6 -159.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 110.885 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -156.34 113.9 3.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.833 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.9 159.03 3.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.516 HG13 ' CE3' ' A' ' 113' ' ' TRP . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.468 ' HG3' ' HB2' ' A' ' 114' ' ' ASN . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.548 ' HE3' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -124.82 129.7 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.535 ' HA ' ' HE1' ' A' ' 107' ' ' MET . 2.4 ttm180 171.53 -157.06 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.039 -179.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.26 -109.95 3.06 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.578 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.443 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 12.6 m -84.06 25.01 0.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.863 0.363 . . . . 0.0 110.815 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.51 ' CA ' HG23 ' A' ' 56' ' ' THR . . . 71.91 29.3 67.31 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.633 ' HE ' ' HB2' ' A' ' 91' ' ' ALA . 16.4 ptt180 -124.05 -148.0 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.698 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.468 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.03 162.76 39.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.634 ' HB3' ' H ' ' A' ' 102' ' ' GLU . 0.4 OUTLIER -50.07 -15.87 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.519 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.7 m 74.1 50.88 0.11 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.051 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.58 16.5 2.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.766 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 15.1 mtt85 -120.87 -32.22 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.995 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER 68.4 148.48 0.06 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.154 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.415 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp -104.35 -155.42 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.919 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.511 ' HA3' HG21 ' A' ' 62' ' ' THR . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.719 HG12 HG23 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.413 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.43 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.475 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.424 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 5' ' ' CYS . . . -46.71 156.15 0.21 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.4 m -94.47 85.61 4.6 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.746 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -127.3 144.37 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.957 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.46 80.07 8.57 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.742 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.27 112.21 2.93 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.559 2.173 . . . . 0.0 112.295 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.27 7.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.605 2.203 . . . . 0.0 112.448 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.34 110.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.8 p -76.34 178.19 6.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 55.98 35.85 26.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.046 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.88 115.29 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.487 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.2 p -144.24 -28.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.724 0.297 . . . . 0.0 110.875 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.68 28.89 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.243 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.902 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.834 0.35 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.14 -171.08 30.83 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.525 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -69.08 161.94 27.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 0.0 110.847 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.09 -18.53 6.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 132' ' ' THR . 83.1 m -66.48 88.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -172.38 60.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.005 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.2 -6.54 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.91 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.703 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.503 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.699 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.703 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.518 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.564 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.404 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.675 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.575 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt -139.25 153.22 47.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.1 100.02 0.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.754 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.412 ' HG1' ' HB3' ' A' ' 125' ' ' TRP . 0.2 OUTLIER -158.01 -158.11 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 110.826 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.484 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 1.2 ttmt -112.61 -93.21 0.47 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.265 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.484 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 6.9 mt-30 -123.24 -169.78 2.0 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.444 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.542 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.542 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.772 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.403 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.772 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.62 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.505 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.505 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.812 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.649 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.831 HG23 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.595 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.665 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.665 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.454 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.831 HD22 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.565 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 -66.36 -30.82 71.29 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -84.08 93.01 8.02 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.899 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.59 -75.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -123.12 18.28 9.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.799 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.504 HG23 ' HA3' ' A' ' 123' ' ' GLY . 12.7 p -134.99 100.97 4.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.887 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.45 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -51.47 167.35 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.902 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.407 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.812 ' HA ' HG21 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.649 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.668 HD21 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.668 ' N ' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.56 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 -87.38 149.64 24.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.42 -71.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.85 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -116.94 -173.46 2.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' HG ' ' H ' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -65.21 -54.41 29.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.87 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.482 ' H ' ' HG ' ' A' ' 73' ' ' LEU . 35.3 mttm -101.15 7.72 43.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.843 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.9 -144.83 0.22 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.451 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -123.87 138.23 54.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.56 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -75.32 138.81 42.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.568 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.649 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.516 HG23 ' CG ' ' A' ' 77' ' ' PHE . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.478 ' HB3' HG12 ' A' ' 85' ' ' VAL . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.702 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 -142.39 -8.05 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.55 ' C ' ' O ' ' A' ' 89' ' ' ASN . 31.5 m0 -9.33 103.74 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 O-C-N 123.409 0.443 . . . . 0.0 111.963 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.483 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -53.57 110.7 2.19 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.309 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.41 91.24 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.643 2.229 . . . . 0.0 112.137 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 156.55 -16.26 0.4 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.455 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.12 78.44 17.45 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.901 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.76 -10.66 26.8 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.534 2.156 . . . . 0.0 112.363 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.432 HG21 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.52 -166.51 0.12 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.922 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.432 ' H ' HG21 ' A' ' 96' ' ' THR . 20.7 m -101.88 -177.82 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.66 95.2 4.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.868 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -134.72 160.1 39.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.428 ' HA ' HD22 ' A' ' 73' ' ' LEU . 9.3 pt20 -97.84 141.25 31.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.897 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.96 -137.9 6.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.549 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -69.36 164.55 22.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 0.0 111.007 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.453 ' CB ' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -148.38 113.28 5.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.663 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.493 ' N ' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -149.91 149.55 30.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 -179.533 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 130.61 52.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.63 -81.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.749 0.309 . . . . 0.0 111.694 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -46.43 133.04 11.21 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.41 -179.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.505 ' HB2' ' HD2' ' A' ' 112' ' ' ARG . 5.5 m 56.68 26.33 11.13 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.476 ' CA ' HG23 ' A' ' 56' ' ' THR . . . 51.18 42.13 48.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.718 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.505 ' HD2' ' HB2' ' A' ' 110' ' ' SER . 6.5 ptp180 -142.78 -144.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.702 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.538 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -149.85 164.25 35.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.472 ' CD1' ' HB2' ' A' ' 119' ' ' ASP . 0.1 OUTLIER -69.0 29.55 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.941 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.538 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER 53.42 29.77 9.38 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 122.415 0.286 . . . . 0.0 111.709 179.373 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.472 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 18.1 t70 -77.26 -2.72 36.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.909 0.385 . . . . 0.0 110.781 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.53 -162.17 0.9 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.863 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -158.15 121.64 3.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.445 HD22 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp -88.91 -149.79 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.63 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.504 ' HA3' HG23 ' A' ' 62' ' ' THR . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.575 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.412 ' HB3' ' HG1' ' A' ' 26' ' ' THR . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.694 HG13 HG23 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.472 ' N ' HG12 ' A' ' 126' ' ' VAL . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.406 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.62 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.427 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -50.26 163.08 0.17 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.447 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 40.2 m -94.6 86.66 4.85 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.894 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.75 177.04 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 76.6 p -88.51 148.41 42.04 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.885 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 114.32 3.23 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.538 2.159 . . . . 0.0 112.239 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.13 105.36 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.552 2.168 . . . . 0.0 112.35 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -85.88 -66.95 0.85 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.069 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.98 139.59 39.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.828 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.65 149.12 50.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.874 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.84 118.7 9.14 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.525 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.3 p -107.95 -64.24 1.23 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 58.99 -90.72 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.279 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.859 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.827 0.346 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.99 94.53 1.97 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.503 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -92.16 122.65 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.2 m -118.52 -46.04 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.132 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -166.44 -165.49 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.983 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -145.33 57.79 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.855 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t -91.51 16.52 10.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.745 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.508 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.745 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.532 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.585 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.704 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.674 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm -128.43 153.11 47.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.415 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 162.7 128.01 0.92 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.536 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.1 m -93.87 118.58 31.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.485 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -170.06 -141.76 0.03 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.669 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.464 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 40.3 mt-30 -117.75 173.54 6.68 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.491 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.769 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.769 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.426 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.494 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.754 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.634 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.545 HG23 ' HA ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.499 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.433 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.566 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.433 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.566 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.611 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 -67.99 -30.52 69.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 121.86 14.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.184 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 p -61.78 -45.38 94.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -94.49 12.94 25.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.785 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.83 50.81 13.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.612 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . -158.42 107.61 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.558 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.622 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.485 ' HH2' ' H ' ' A' ' 27' ' ' LYS . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.754 ' HA ' HG22 ' A' ' 44' ' ' VAL . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.634 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.531 ' HB2' HG13 ' A' ' 66' ' ' ILE . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.491 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.549 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 3.0 t30 -84.9 152.77 23.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.05 -89.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.451 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.4 94.76 2.83 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.79 0.329 . . . . 0.0 111.385 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.418 ' HA ' ' N ' ' A' ' 102' ' ' GLU . 4.1 mp 56.29 -92.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.63 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? -76.06 7.39 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.427 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.58 -171.86 10.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.429 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -99.89 135.28 41.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 0.0 110.473 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -70.69 120.44 16.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.464 ' CD1' ' HG ' ' A' ' 68' ' ' LEU . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.605 HG12 ' CA ' ' A' ' 67' ' ' GLY . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.528 ' CG2' HD22 ' A' ' 68' ' ' LEU . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.472 ' N ' HG11 ' A' ' 85' ' ' VAL . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.4 ' HB3' HG12 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.566 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 1.2 t-20 -88.51 -39.96 13.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.441 ' C ' ' O ' ' A' ' 89' ' ' ASN . 16.9 m0 26.0 85.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.418 ' HB3' ' HG3' ' A' ' 112' ' ' ARG . . . -56.41 123.48 56.22 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.124 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -84.72 0.48 8.99 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.76 2.307 . . . . 0.0 112.47 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -84.8 4.57 84.72 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.598 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.78 77.8 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.729 0.299 . . . . 0.0 110.97 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.47 97.52 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.596 2.197 . . . . 0.0 112.281 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.439 HG21 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.27 -165.78 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.042 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.439 ' H ' HG21 ' A' ' 96' ' ' THR . 5.0 t -150.77 -58.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.918 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -158.14 -55.08 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 26.1 p -156.3 24.39 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.86 92.74 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.996 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.405 ' HA3' HD23 ' A' ' 73' ' ' LEU . . . -69.4 148.92 47.94 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.436 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.418 ' N ' ' HA ' ' A' ' 73' ' ' LEU . 12.7 mt-10 -75.08 128.98 36.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.925 0.393 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -147.54 -33.99 0.26 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.361 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 144.32 30.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.038 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.464 HG13 ' CE3' ' A' ' 113' ' ' TRP . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.453 ' HE1' ' HB2' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.622 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.05 130.01 52.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.402 ' HB2' ' O ' ' A' ' 107' ' ' MET . 0.0 OUTLIER 176.67 -20.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.127 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -51.49 -70.89 0.75 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.742 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 m -150.34 47.15 0.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.786 0.326 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.448 ' HA2' HG22 ' A' ' 56' ' ' THR . . . 91.38 -9.27 77.78 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.736 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.418 ' HG3' ' HB3' ' A' ' 91' ' ' ALA . 1.6 ptp180 -112.13 -154.82 0.55 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.566 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.453 ' HB2' ' HE1' ' A' ' 106' ' ' MET . . . -157.18 161.5 39.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.79 160.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.664 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.91 71.71 1.55 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.898 0.38 . . . . 0.0 111.097 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -112.12 -32.18 6.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.371 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 148.76 37.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.478 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.33 108.91 17.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.085 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.473 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.7 mp -85.09 -163.56 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.544 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.492 HG11 ' CG2' ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.426 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.474 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.03 87.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.7 p -131.97 109.91 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 2.2 m -83.18 -5.64 59.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.945 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.1 p -127.18 72.2 76.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.82 154.31 48.52 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.635 2.223 . . . . 0.0 112.292 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.93 87.06 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.539 2.159 . . . . 0.0 112.296 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.99 -14.13 32.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.141 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.8 m -70.94 132.45 45.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -89.29 4.24 49.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -71.7 97.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.72 102.75 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.859 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.16 -166.8 0.13 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.243 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.915 -179.979 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.7 74.7 0.4 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.52 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.81 145.6 28.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.714 0.293 . . . . 0.0 110.97 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.713 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 15.2 m -81.7 -173.68 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.067 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 60.2 m 55.07 69.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -165.34 50.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.024 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t -95.41 1.65 54.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.694 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.516 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.5 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.694 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.632 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.503 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.637 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.637 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.6 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.652 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.531 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER -114.37 161.02 18.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.523 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -172.57 -164.29 27.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.64 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.54 78.15 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 110.761 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.428 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 3.7 mmtp -154.24 -139.54 0.08 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.864 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.428 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 11.3 mt-30 -118.38 -175.04 2.79 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.454 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.55 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.404 ' CE1' ' HD2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.43 ' HB1' HD12 ' A' ' 43' ' ' LEU . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.502 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.502 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.748 HG21 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.449 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.499 ' HB2' HG23 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.621 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.621 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.748 HD21 HG21 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -64.07 -31.37 72.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.73 108.82 2.22 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.024 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.6 m -62.09 -80.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.61 -60.49 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -76.14 -162.73 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.87 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -118.33 -166.83 13.83 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.465 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.657 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.467 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.454 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.701 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 2.1 m120 -67.5 151.71 46.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.8 -26.8 60.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.64 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.514 HD11 ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -158.44 -74.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.692 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.514 ' HG2' HD11 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -101.36 7.58 42.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.91 -115.15 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.693 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -127.48 129.06 46.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.37 . . . . 0.0 111.311 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.628 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -70.95 128.61 36.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.994 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.448 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.647 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.508 HG22 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.428 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.68 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 -144.49 -20.92 0.53 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.525 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.41 109.83 0.09 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.098 0.475 . . . . 0.0 111.415 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.9 114.25 2.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.33 -179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.61 -21.08 53.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.567 2.178 . . . . 0.0 112.332 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.24 27.37 6.23 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.482 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.423 ' HG3' HD21 ' A' ' 114' ' ' ASN . 0.6 OUTLIER -128.66 79.15 74.86 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.818 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -56.77 129.82 36.62 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.612 2.208 . . . . 0.0 112.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.4 t -72.47 147.28 46.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.942 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.4 m -93.26 -71.47 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -158.31 156.73 31.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.409 ' HG ' ' HB2' ' A' ' 117' ' ' PHE . 3.3 m -162.05 171.74 17.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.07 -71.47 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.86 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.8 176.78 52.56 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.403 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.407 ' HB3' ' HG2' ' A' ' 69' ' ' ARG . 60.7 mt-10 -49.42 117.91 2.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.701 ' HB2' ' HB2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -73.23 177.18 5.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 150.12 37.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.543 HG13 ' CE3' ' A' ' 113' ' ' TRP . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.451 ' HB2' ' CD2' ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.621 ' HE1' ' N ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -123.04 136.24 54.75 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.621 ' N ' ' HE1' ' A' ' 107' ' ' MET . 0.0 OUTLIER 178.28 135.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.814 -179.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 120.63 -123.14 5.47 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.78 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.5 m -58.9 -31.52 68.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.699 0.285 . . . . 0.0 111.242 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.475 ' HA2' HG23 ' A' ' 56' ' ' THR . . . 131.95 26.67 0.68 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.524 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.558 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -128.81 -155.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.68 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.423 HD21 ' HG3' ' A' ' 94' ' ' GLU . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.525 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.76 40.07 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.409 ' HB2' ' HG ' ' A' ' 99' ' ' SER . 41.7 t80 -38.1 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.164 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 170.54 33.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.607 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.6 59.73 0.69 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.07 -32.39 3.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.792 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.5 mttt 59.37 95.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.465 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.9 mp -85.38 -152.72 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.579 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.465 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.531 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.523 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.545 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.474 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -42.0 148.49 0.18 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.0 m -94.37 96.64 9.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.003 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.713 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 35.3 m -127.48 -179.48 4.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.4 t -68.01 142.32 95.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -68.73 140.41 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.555 2.17 . . . . 0.0 112.284 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.35 2.8 5.85 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.648 2.232 . . . . 0.0 112.311 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.46 79.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.148 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.4 p -82.57 155.78 24.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 56.02 37.66 29.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.977 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.7 131.47 10.44 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.513 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.77 -35.43 4.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.801 0.334 . . . . 0.0 110.916 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -111.53 69.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.896 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.758 0.313 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.12 -156.29 26.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.535 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.83 89.37 1.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 15.9 m -85.47 -162.74 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.083 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.29 -159.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.961 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -137.86 61.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.841 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t -89.21 11.82 17.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.93 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.823 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.497 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.568 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.823 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.539 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.2 t-20 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.638 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.514 ' HA2' ' HZ2' ' A' ' 11' ' ' LYS . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt -130.92 155.72 46.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.97 -123.12 7.36 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.859 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.435 ' OG1' ' HB3' ' A' ' 125' ' ' TRP . 0.3 OUTLIER 59.44 -165.22 0.2 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.724 0.297 . . . . 0.0 111.159 -179.849 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -128.52 -78.01 0.56 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.225 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -122.87 -170.72 2.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.109 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.53 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.715 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.715 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.836 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.593 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.765 HG22 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.643 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.432 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.765 HD21 HG22 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.568 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 -65.1 -32.4 74.09 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.56 108.83 4.52 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.031 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.33 2.41 28.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -98.54 -74.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.562 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 2.7 m -142.98 -38.72 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.497 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 171.26 -173.59 44.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.543 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.828 ' HB2' HG22 ' A' ' 126' ' ' VAL . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.428 ' CZ3' ' HB ' ' A' ' 26' ' ' THR . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.836 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.635 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.512 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.429 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -88.99 149.22 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.98 -77.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.167 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -110.18 -77.16 0.6 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.973 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.468 HD13 ' HG ' ' A' ' 99' ' ' SER . 0.3 OUTLIER -160.7 -51.14 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.895 -179.918 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -100.71 7.46 43.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.57 -127.27 0.73 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.443 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -127.15 142.97 51.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.601 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -81.38 124.89 29.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.3 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.418 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.635 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.44 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.479 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.665 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 87.7 m-20 -138.68 -15.11 1.21 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.527 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -38.15 110.48 0.13 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-O 121.022 0.439 . . . . 0.0 111.149 -179.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -42.5 134.44 2.69 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.512 -179.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.18 -17.99 24.03 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.568 2.178 . . . . 0.0 112.276 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.93 12.87 58.67 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.493 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -126.44 76.65 73.4 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.669 0.271 . . . . 0.0 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.65 -11.82 28.4 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.611 2.207 . . . . 0.0 112.269 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 58.44 -174.71 0.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -164.82 -172.98 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.867 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 57.71 -166.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.035 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.468 ' HG ' HD13 ' A' ' 73' ' ' LEU . 1.4 m -153.3 147.94 26.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.33 -174.92 4.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.817 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -100.19 -16.02 28.8 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.509 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.833 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 16.3 mm-40 -67.87 167.5 13.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.689 0.281 . . . . 0.0 110.825 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -172.65 106.75 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.092 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p -161.25 145.59 13.39 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' CE3' ' A' ' 113' ' ' TRP . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.617 ' HE2' ' HB2' ' A' ' 114' ' ' ASN . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.469 ' HE2' ' HB3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.14 130.76 53.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.56 -178.69 4.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.233 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -73.49 -17.96 79.22 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.568 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -56.01 -45.6 79.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.913 0.387 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.469 ' HA2' ' CG2' ' A' ' 56' ' ' THR . . . 127.55 28.41 0.9 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.866 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.467 ' HD2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -150.7 -159.33 1.02 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.665 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.617 ' HB2' ' HE2' ' A' ' 106' ' ' MET . 15.3 m-20 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.527 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.48 161.64 40.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.661 ' HB3' ' HB2' ' A' ' 102' ' ' GLU . 16.5 m-85 -44.42 -75.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.833 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.5 OUTLIER 174.36 31.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.31 -27.53 27.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.573 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -68.0 124.06 22.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.706 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.8 107.71 19.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.562 ' HA ' ' HB ' ' A' ' 62' ' ' THR . 5.2 mp -85.03 -162.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.734 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.582 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.435 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.828 HG22 ' HB2' ' A' ' 64' ' ' SER . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.449 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -61.02 92.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.7 p -131.66 -173.53 3.15 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 11.2 m -137.77 -57.12 0.68 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 68.8 p -68.02 141.57 94.44 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.43 127.5 13.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.565 2.177 . . . . 0.0 112.353 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -57.59 96.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.56 2.173 . . . . 0.0 112.316 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.75 -166.0 0.13 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.185 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -172.33 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 55.43 35.57 25.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.987 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -81.48 117.92 4.52 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.486 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 m -73.22 127.39 32.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.868 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.82 87.48 3.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.06 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.857 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.725 0.298 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.3 -137.42 11.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.493 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.0 159.74 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.766 0.317 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.4 t -85.33 126.66 40.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.202 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.52 116.98 28.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.824 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -155.7 28.48 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.935 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t -89.78 4.8 48.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.902 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.746 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.52 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.611 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.746 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.559 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.699 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.709 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt -116.94 162.56 17.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.434 ' HA3' ' CE2' ' A' ' 125' ' ' TRP . . . 145.95 129.25 2.04 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.642 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.5 p -95.85 127.76 42.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.772 0.32 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.54 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -172.88 -143.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 1.8 mm-40 -115.74 171.42 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.714 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.472 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.654 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.654 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.429 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.534 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.834 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.679 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.655 HG21 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.525 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.704 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.426 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.709 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.639 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.611 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 -66.42 -30.79 71.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.45 114.12 5.86 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.039 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.09 5.48 38.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.998 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.17 -75.64 0.59 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.866 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.5 m -147.26 -40.75 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.841 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.483 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -178.16 -176.44 46.12 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.491 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.55 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.532 ' HH2' ' H ' ' A' ' 27' ' ' LYS . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.834 ' HA ' HG22 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.679 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.643 HD21 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.643 ' N ' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.576 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 -89.07 148.75 23.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.803 ' HB2' ' HB2' ' A' ' 74' ' ' LYS . 10.2 mt -54.5 176.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.108 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -60.59 80.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.955 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.563 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 2.9 mp 50.22 25.71 1.9 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.989 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.803 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 27.3 mttt -76.63 -18.81 58.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.233 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA2' ' OE2' ' A' ' 102' ' ' GLU . . . 94.6 -3.82 68.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.37 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' HB2' HD11 ' A' ' 71' ' ' LEU . 1.8 mm-40 -111.42 122.92 49.12 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 117.198 0.499 . . . . 0.0 110.85 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -90.17 142.06 28.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.538 ' CD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.645 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.53 HG21 ' CG ' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.439 ' N ' HG12 ' A' ' 85' ' ' VAL . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.508 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.712 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 57.4 m-20 -128.51 -24.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.477 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.6 m0 16.36 101.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.651 ' HB1' ' HG3' ' A' ' 112' ' ' ARG . . . -49.53 108.78 1.05 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.354 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -67.37 126.52 15.06 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.769 2.313 . . . . 0.0 112.24 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 60.59 25.87 63.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.534 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.63 ' HB2' ' HB2' ' A' ' 91' ' ' ALA . 6.2 mt-10 -136.6 73.87 54.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.687 0.28 . . . . 0.0 110.789 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.32 -75.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.525 2.15 . . . . 0.0 112.312 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.67 33.79 20.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.988 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.5 p -142.31 112.88 7.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . 0.43 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -72.87 -28.98 62.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.861 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.2 m -86.17 109.29 18.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.05 -41.36 92.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.563 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -70.7 134.09 23.69 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.399 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.49 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -106.22 149.73 26.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.938 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.427 ' HA ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -136.46 -24.07 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.671 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 23.9 m -154.97 158.48 39.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.084 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.517 HG23 ' HA ' ' A' ' 115' ' ' ASP . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.55 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.09 130.43 53.75 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.3 mtp180 -88.89 166.7 13.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.2 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.33 -22.63 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.318 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.585 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 48.0 m -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.356 . . . . 0.0 110.679 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.468 ' HA2' HG22 ' A' ' 56' ' ' THR . . . 116.16 35.28 1.24 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.952 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.651 ' HG3' ' HB1' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -150.18 -163.85 1.88 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.712 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.517 ' HA ' HG23 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.08 161.28 39.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.49 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 17.4 t80 -41.57 135.88 2.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.629 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.0 OUTLIER -78.64 66.98 4.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.134 -179.725 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.2 -0.93 16.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.5 mmt180 -92.72 -161.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.806 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . 0.54 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 21.9 ttmt -154.4 115.98 4.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.021 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.474 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 6.5 mp -85.54 -139.61 0.08 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.552 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.455 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.434 ' CE2' ' HA3' ' A' ' 25' ' ' GLY . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.549 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.429 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.415 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.45 -166.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 36.69 1.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.38 64.23 1.47 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.5 t -108.05 141.58 23.44 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.26 120.36 8.16 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.573 2.182 . . . . 0.0 112.293 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.84 104.22 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.545 2.164 . . . . 0.0 112.281 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.34 -65.46 1.01 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.076 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -111.69 153.58 26.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -70.01 123.85 22.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -109.28 -27.79 4.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.475 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 4.7 p -157.88 -43.22 0.06 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.766 0.317 . . . . 0.0 110.86 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.95 -164.98 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.247 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.863 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.17 177.23 23.96 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.879 -0.676 . . . . 0.0 112.544 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.04 168.42 17.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.757 0.313 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.17 126.1 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -141.5 87.62 2.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -173.2 83.65 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -3.36 11.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.749 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.493 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.591 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.749 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.577 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.573 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt -140.79 153.14 45.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.517 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 90.75 87.41 1.38 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.568 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.43 ' HG1' ' HB3' ' A' ' 125' ' ' TRP . 0.1 OUTLIER -152.27 -159.66 1.04 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.685 0.278 . . . . 0.0 110.82 179.964 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HG2' ' HG3' ' A' ' 28' ' ' GLN . 4.0 ttmm -113.06 -90.88 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.2 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.489 ' HG3' ' HG2' ' A' ' 27' ' ' LYS . 44.2 mt-30 -123.22 -170.76 2.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.511 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.601 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.402 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.455 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.601 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.48 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.837 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.628 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.799 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.41 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.515 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.529 ' HB2' HG23 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.6 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.6 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.463 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.799 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.575 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.556 ' N ' HG23 ' A' ' 56' ' ' THR . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.591 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 -68.67 -30.47 69.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -78.77 86.13 4.72 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.086 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.58 -53.3 4.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -51.57 59.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.964 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.435 ' HB ' ' N ' ' A' ' 123' ' ' GLY . 0.0 OUTLIER -150.53 161.97 41.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.928 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.507 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -59.61 178.99 2.15 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.974 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.401 ' HB2' HG22 ' A' ' 126' ' ' VAL . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.455 ' NE1' HD11 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.837 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.648 ' CA ' HG11 ' A' ' 80' ' ' VAL . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.584 ' HG ' HG22 ' A' ' 105' ' ' VAL . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -96.23 139.07 32.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.7 129.06 38.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.146 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 55.85 -97.01 0.07 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.171 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.509 ' HA ' ' O ' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -163.18 -39.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.844 0.354 . . . . 0.0 111.002 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 7.6 42.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.15 -136.63 1.6 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.518 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.21 147.11 50.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.71 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.527 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -73.79 132.72 42.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.403 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.446 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.648 HG11 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.403 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.527 HG21 ' CG ' ' A' ' 77' ' ' PHE . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.425 ' N ' HG13 ' A' ' 85' ' ' VAL . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.423 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.668 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 62.4 m-20 -131.64 -23.09 2.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.493 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.8 m0 13.33 101.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.539 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -54.34 124.21 46.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.704 0.288 . . . . 0.0 111.036 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -84.02 15.53 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.685 2.257 . . . . 0.0 112.493 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.04 -2.39 90.63 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.562 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.67 79.33 9.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.742 0.306 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.17 -48.11 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.544 2.163 . . . . 0.0 112.214 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 47.1 p -91.74 142.19 27.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.5 p -157.64 141.71 16.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.991 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.62 -2.36 56.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.4 p -118.78 127.69 53.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -102.29 27.48 6.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.36 125.56 7.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.516 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HG3' ' HA ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.57 104.46 2.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.834 0.35 . . . . 0.0 110.833 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -127.38 -21.88 3.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.506 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 24.1 m -154.95 158.18 38.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.584 HG22 ' HG ' ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.403 ' HB3' HD13 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.502 ' HE1' ' HA ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -124.91 129.56 50.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.502 ' HA ' ' HE1' ' A' ' 107' ' ' MET . 2.7 ptm180 171.87 -159.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.033 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.18 -107.78 1.86 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.649 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.46 ' HB2' ' CD ' ' A' ' 112' ' ' ARG . 6.6 m -84.96 29.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.844 0.354 . . . . 0.0 111.041 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.508 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 65.46 30.82 78.46 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.4 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.539 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 3.6 ptp180 -127.47 -148.24 0.38 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.668 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.55 ' HA ' ' HG3' ' A' ' 102' ' ' GLU . . . -157.93 161.25 38.19 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -43.93 128.22 5.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.039 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.506 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.5 OUTLIER -75.14 77.52 2.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.99 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.86 55.37 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.129 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.444 ' HD2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.57 96.77 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.544 179.604 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.48 -14.66 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.961 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.507 HD23 ' HA3' ' A' ' 63' ' ' GLY . 2.1 mp -114.69 -161.6 0.78 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.435 ' N ' ' HB ' ' A' ' 62' ' ' THR . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.43 ' HB3' ' HG1' ' A' ' 26' ' ' THR . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.467 HG11 ' CG2' ' A' ' 44' ' ' VAL . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.471 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.417 ' N ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -52.78 170.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.538 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 75.5 m -94.41 103.82 15.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.957 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -166.58 -10.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.849 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.475 ' H ' ' HD2' ' A' ' 135' ' ' PRO . 0.0 OUTLIER -162.08 -52.49 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.411 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . 0.547 ' HB2' ' HD3' ' A' ' 136' ' ' PRO . 71.0 Cg_exo -48.16 -47.98 17.97 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.33 2.02 . . . . 0.0 113.208 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.547 ' HD3' ' HB2' ' A' ' 135' ' ' PRO . 45.7 Cg_exo -56.55 137.74 81.88 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.046 1.831 . . . . 0.0 112.314 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.2 40.13 30.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.207 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 -64.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 56.33 40.76 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.051 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.75 117.12 4.34 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.458 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.16 -53.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -104.57 27.19 8.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.957 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.866 0.365 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.67 -60.58 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.551 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.86 121.33 33.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.749 0.309 . . . . 0.0 110.975 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.3 t -107.45 -51.92 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.098 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.485 ' HB3' ' H ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -150.53 -96.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.897 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.485 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 1.8 t-20 -175.98 52.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.856 0.36 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.519 ' HB ' ' O ' ' A' ' 132' ' ' THR . 0.7 OUTLIER -87.35 1.23 53.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.42 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.708 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.497 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.577 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.4 t-20 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.425 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.679 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp -131.79 155.57 47.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.54 -125.34 8.22 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.907 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.831 HG21 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.32 -164.77 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.715 0.293 . . . . 0.0 111.043 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.36 -76.99 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.338 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -122.17 -170.4 2.06 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.165 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.546 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.831 ' HB3' HG21 ' A' ' 26' ' ' THR . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.546 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.548 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.471 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.546 ' HB3' ' CA ' ' A' ' 67' ' ' GLY . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.779 HG21 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.603 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.78 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.439 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.438 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.494 ' CB ' HG22 ' A' ' 46' ' ' ILE . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.625 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.438 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.78 HD21 HG23 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.625 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.528 ' N ' HG21 ' A' ' 56' ' ' THR . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.42 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 -66.19 -31.88 72.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.4 96.2 0.08 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.103 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.4 p -96.82 50.36 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -153.89 -71.66 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.858 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.586 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.2 OUTLIER -146.64 -36.81 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.896 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 169.04 -172.86 43.46 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.57 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.555 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.441 ' HE3' ' HA ' ' A' ' 125' ' ' TRP . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.779 ' HA ' HG21 ' A' ' 44' ' ' VAL . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.61 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.494 ' CD1' ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -93.92 138.05 32.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 146.63 39.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.038 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.04 -93.69 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.076 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.688 HD13 ' HG2' ' A' ' 74' ' ' LYS . 0.2 OUTLIER -167.45 -54.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.842 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.688 ' HG2' HD13 ' A' ' 73' ' ' LEU . 2.5 pttt -101.23 7.64 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.13 -133.22 0.11 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.653 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -118.73 146.31 44.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.735 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 77' ' ' PHE . 0.4 OUTLIER -79.61 122.15 26.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 -179.722 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.433 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.61 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.49 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.708 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 83.9 m-20 -136.94 -15.26 1.54 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.613 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -39.85 102.58 0.03 OUTLIER 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.11 0.481 . . . . 0.0 111.206 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.25 120.71 10.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.447 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.58 -5.87 8.04 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.842 2.361 . . . . 0.0 112.421 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.47 11.27 52.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.596 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -129.39 72.24 81.98 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.3 116.24 3.07 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.622 2.214 . . . . 0.0 112.315 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.6 p -73.69 126.74 31.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.918 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.12 -29.66 0.76 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.869 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -31.03 70.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.941 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.1 t -158.3 156.73 31.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -128.86 153.41 47.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.567 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 175.0 -77.74 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 22.4 mt-10 60.84 100.81 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.908 0.385 . . . . 0.0 111.158 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.463 ' HB3' ' O ' ' A' ' 117' ' ' PHE . 34.8 t70 -149.26 -27.34 0.28 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.623 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -140.79 145.22 36.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.275 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.492 HG11 ' CE3' ' A' ' 113' ' ' TRP . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.527 ' HE3' ' HB2' ' A' ' 114' ' ' ASN . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.555 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.31 132.09 54.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.79 -174.88 2.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.05 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.67 -10.55 58.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.672 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 58.8 m -59.44 -42.65 92.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.765 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.427 ' HA2' ' CG2' ' A' ' 56' ' ' THR . . . 127.86 -8.72 6.81 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.787 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.492 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -127.15 -155.64 0.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.708 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.527 ' HB2' ' HE3' ' A' ' 106' ' ' MET . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.613 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.62 40.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.567 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 30.8 t80 -41.76 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.81 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.95 31.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.84 -15.68 23.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.579 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -63.12 122.55 16.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.702 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.3 102.39 14.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.586 ' HA ' ' HB ' ' A' ' 62' ' ' THR . 5.4 mp -85.18 -153.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.587 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.408 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.744 HG13 HG23 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.423 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.409 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.444 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.88 118.04 2.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.519 ' O ' ' HB ' ' A' ' 7' ' ' THR . 19.9 p -131.46 -160.04 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.987 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.431 ' H ' ' HB ' ' A' ' 132' ' ' THR . 1.9 t -126.24 107.74 10.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.71 114.59 27.83 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.029 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.0 140.56 28.62 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.543 2.162 . . . . 0.0 112.313 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.08 92.48 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.505 2.137 . . . . 0.0 112.36 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.24 87.32 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.0 p -73.94 177.57 5.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 55.72 39.35 30.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.52 14.16 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.484 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' SER . . . . . 0.406 ' O ' ' HG2' ' A' ' 143' ' ' GLU . 0.7 OUTLIER -78.37 -171.69 2.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.901 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.74 96.35 0.4 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.13 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 141' ' ' SER . 8.2 pt-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.787 0.327 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.17 -37.83 0.14 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.494 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.82 145.56 34.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.904 0.383 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.3 t -104.56 -48.68 9.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.108 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.0 t -143.19 -101.36 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.971 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -176.5 50.52 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.902 0.382 . . . . 0.0 110.833 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t -84.11 0.85 46.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.095 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.534 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.593 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.647 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.553 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.662 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm -129.48 155.65 45.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.77 -125.59 7.84 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.851 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.747 HG23 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER 59.9 -166.32 0.19 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.852 0.358 . . . . 0.0 111.169 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -126.3 -78.89 0.59 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.243 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -121.63 -171.09 2.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.472 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.747 ' HB3' HG23 ' A' ' 26' ' ' THR . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.517 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.876 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.434 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.456 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.876 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.713 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.503 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.503 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.799 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.571 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.53 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.532 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.426 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.71 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.426 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.662 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.573 ' N ' HG22 ' A' ' 56' ' ' THR . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.534 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 -69.1 -32.12 71.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.88 -1.84 15.76 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.65 -148.48 0.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -54.66 -31.99 58.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.113 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.656 HG23 ' HA3' ' A' ' 123' ' ' GLY . 0.0 OUTLIER -76.94 -169.4 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.477 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -123.58 175.98 16.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.701 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.77 ' HB2' HG22 ' A' ' 126' ' ' VAL . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.432 ' CZ3' ' HB ' ' A' ' 26' ' ' THR . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.799 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.624 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.546 ' HG ' HG22 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.472 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.513 ' ND2' ' HG3' ' A' ' 102' ' ' GLU . 13.9 t-20 -95.09 135.12 37.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mt -98.94 157.7 16.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.076 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 58.07 20.06 6.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.821 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 3.6 mp 59.71 -85.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -77.37 7.55 5.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.21 -125.06 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -127.26 146.77 50.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.998 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -75.29 135.32 40.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.458 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.624 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.571 HG21 ' CG ' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.71 HD22 ' HG2' ' A' ' 52' ' ' GLN . 52.2 m-20 -127.42 -31.89 2.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.485 ' C ' ' O ' ' A' ' 89' ' ' ASN . 30.5 m0 22.01 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.478 0.486 . . . . 0.0 112.017 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.526 ' HB2' ' HB2' ' A' ' 112' ' ' ARG . . . -49.36 114.66 4.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.661 0.267 . . . . 0.0 111.296 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.06 109.92 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.572 2.181 . . . . 0.0 112.285 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 149.47 -32.46 1.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.535 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -124.6 78.62 63.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.322 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.3 -7.85 22.17 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.598 2.199 . . . . 0.0 112.419 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.454 HG21 ' HB1' ' A' ' 116' ' ' ALA . 11.2 p 51.07 34.83 11.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.097 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.1 p -80.7 154.91 27.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.875 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 56.59 29.26 15.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.0 m -132.9 -168.98 2.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.839 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -63.08 145.94 54.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.821 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -64.15 140.29 43.33 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.516 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.54 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 2.1 pm0 -66.43 148.89 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.895 0.379 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -136.69 -26.35 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.83 154.33 38.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.52 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.546 HG22 ' HG ' ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.693 ' HE1' ' HB2' ' A' ' 108' ' ' ARG . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.547 ' HE1' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -121.18 130.5 53.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.693 ' HB2' ' HE1' ' A' ' 106' ' ' MET . 0.4 OUTLIER 179.63 -164.94 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.753 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.92 -58.94 5.02 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.545 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.527 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 51.6 m -155.14 -1.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.634 0.254 . . . . 0.0 111.141 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.544 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 121.99 8.94 7.05 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.329 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.527 ' NE ' ' HB2' ' A' ' 110' ' ' SER . 1.3 mpt_? -104.8 -156.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.454 ' HB1' HG21 ' A' ' 96' ' ' THR . . . -156.81 161.73 39.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.54 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 25.4 t80 -45.42 156.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.073 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -78.19 64.56 3.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.082 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -109.15 -15.45 14.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -90.62 175.74 6.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.787 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -138.68 117.75 12.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.074 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.449 ' HG ' ' HE3' ' A' ' 106' ' ' MET . 5.8 mp -86.49 -143.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.422 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.656 ' HA3' HG23 ' A' ' 62' ' ' THR . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.77 HG22 ' HB2' ' A' ' 64' ' ' SER . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.44 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.713 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.84 95.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 44.6 p -131.86 134.01 45.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.36 152.01 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.34 107.79 6.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . 0.503 ' N ' ' HD2' ' A' ' 136' ' ' PRO . 73.2 Cg_exo -48.23 -48.05 17.93 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.691 2.261 . . . . 0.0 113.204 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . 0.503 ' HD2' ' N ' ' A' ' 135' ' ' PRO . 56.7 Cg_endo -69.98 89.51 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.037 1.824 . . . . 0.0 112.362 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -139.17 -36.2 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -90.2 143.7 26.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.903 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -68.52 119.05 12.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -66.58 133.34 32.56 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.421 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.7 p -138.09 -55.64 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.791 0.329 . . . . 0.0 110.946 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.67 -68.51 0.56 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.184 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.839 180.0 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.826 0.346 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.56 -163.04 22.71 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.468 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -117.57 -50.72 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.838 0.351 . . . . 0.0 110.924 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.5 t -113.19 -52.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 98.9 m -135.72 -102.91 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.16 70.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.789 0.328 . . . . 0.0 110.79 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -94.98 8.72 41.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.779 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.5 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.523 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.779 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.526 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.654 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.674 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.92 161.57 18.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.37 117.36 0.53 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.566 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.494 ' HA ' ' HA2' ' A' ' 123' ' ' GLY . 71.5 p -88.39 115.67 26.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.827 0.346 . . . . 0.0 110.953 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.516 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -168.91 -137.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.784 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.449 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 5.0 mt-30 -123.16 175.54 6.59 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.513 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.554 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.554 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.761 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.498 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.498 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.829 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.652 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.649 HG23 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.507 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.508 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.649 ' HB2' HG23 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.66 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.674 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.66 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.487 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.523 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 -66.13 -29.92 70.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.35 125.32 22.8 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.144 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.4 p -110.96 97.61 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.1 m80 60.5 12.34 3.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.038 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.444 HG22 ' HA3' ' A' ' 123' ' ' GLY . 1.0 OUTLIER -154.05 119.6 5.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.771 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.476 ' HA2' ' SD ' ' A' ' 107' ' ' MET . . . -58.69 178.16 1.75 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.92 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.439 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.516 ' HH2' ' H ' ' A' ' 27' ' ' LYS . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.829 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.652 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.531 HD21 ' HB2' ' A' ' 77' ' ' PHE . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.513 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.11 153.5 23.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.36 -81.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.285 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.625 ' HB3' HD22 ' A' ' 73' ' ' LEU . 54.2 m-20 -125.05 -76.27 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.967 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.625 HD22 ' HB3' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -150.33 -47.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.939 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.34 7.24 42.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.827 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.06 -143.8 3.82 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.525 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -127.5 151.05 49.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.957 0.408 . . . . 0.0 110.869 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.542 ' CG ' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.24 131.75 43.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.458 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.643 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' CG ' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.568 HD22 ' HG2' ' A' ' 52' ' ' GLN . 1.0 OUTLIER -105.38 -36.78 7.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.417 ' C ' ' O ' ' A' ' 89' ' ' ASN . 23.9 m0 27.44 95.26 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 178.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.39 129.9 61.47 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.003 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.88 -12.87 14.59 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.614 2.209 . . . . 0.0 112.402 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.91 6.42 74.76 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.517 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.39 91.61 3.06 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.656 0.265 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.1 106.64 2.2 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.55 2.166 . . . . 0.0 112.321 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 p 53.0 -163.05 0.09 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.121 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.21 111.68 2.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.0 -166.54 0.13 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.035 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -80.27 -40.58 26.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -116.14 176.74 4.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.528 ' O ' ' HA ' ' A' ' 73' ' ' LEU . . . 136.52 -144.99 16.84 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.444 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.438 ' H ' ' N ' ' A' ' 117' ' ' PHE . 3.5 tt0 62.98 120.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 111.424 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.428 ' O ' ' HA ' ' A' ' 69' ' ' ARG . 0.9 OUTLIER -175.18 -36.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p -141.28 143.99 34.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.541 HG13 ' CE3' ' A' ' 113' ' ' TRP . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.432 ' HB2' ' CD2' ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.503 ' HB2' ' HE3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.22 143.47 49.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.477 ' HA ' ' HE1' ' A' ' 107' ' ' MET . 0.0 OUTLIER 175.13 -174.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.768 -179.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.74 -100.17 2.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.8 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.2 m -100.75 -15.72 17.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.725 0.298 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.46 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 127.81 19.22 1.84 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.245 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.409 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -112.27 -157.15 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.589 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.19 162.04 40.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.486 ' HB2' ' HA2' ' A' ' 101' ' ' GLY . 34.3 t80 -37.68 -78.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 173.07 32.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.01 -20.7 48.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.796 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.31 126.69 31.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.823 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 103.56 15.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.973 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.491 ' HB2' ' CZ2' ' A' ' 65' ' ' TRP . 5.2 mp -85.3 -163.95 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.494 ' HA2' ' HA ' ' A' ' 26' ' ' THR . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.536 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.583 HG22 ' CD1' ' A' ' 22' ' ' PHE . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.454 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.11 98.88 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.8 p -131.68 129.36 40.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.989 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.24 97.16 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.814 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.1 p -135.24 149.48 70.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.817 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.49 138.62 46.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.575 2.184 . . . . 0.0 112.331 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.03 97.77 0.95 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.585 2.19 . . . . 0.0 112.357 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 55.88 83.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.167 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.4 t -101.97 129.15 48.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.14 133.47 48.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.21 112.48 4.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.455 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 57.27 23.82 9.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 0.0 111.043 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.07 81.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.912 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.778 0.323 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.8 -27.57 45.83 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.494 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -90.25 130.41 36.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.762 0.315 . . . . 0.0 110.947 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.8 m -108.05 -160.81 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.126 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.33 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.931 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -126.15 53.84 1.59 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.865 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 6.4 t -90.23 6.91 40.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.518 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.454 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.471 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.592 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.696 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.661 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt -139.1 153.06 47.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.537 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 81.29 97.55 0.41 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.684 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.28 -157.81 0.74 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 110.829 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.85 -91.34 0.52 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.291 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -123.51 -170.91 2.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.189 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.462 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.527 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.492 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.702 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.497 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.506 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.827 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.674 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.712 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.54 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.515 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.712 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.733 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.661 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.638 HG23 ' HE2' ' A' ' 107' ' ' MET . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.471 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 -65.48 -30.29 71.05 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.04 102.63 0.3 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.082 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -99.14 -29.75 12.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -76.75 -62.16 1.73 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.494 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -151.37 -63.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.947 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -165.67 179.58 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.556 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.827 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.674 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.644 HD22 ' N ' ' A' ' 69' ' ' ARG . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.644 ' N ' HD22 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.528 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -84.56 154.15 22.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.432 ' HB3' ' HD3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -69.52 85.15 0.43 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.04 -179.62 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 73' ' ' LEU . 0.7 OUTLIER 58.71 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.98 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.405 ' H ' ' HB3' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -158.85 31.19 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.765 -179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.432 ' HD3' ' HB3' ' A' ' 71' ' ' LEU . 1.6 mtpp -75.93 -18.31 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.031 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 100.51 15.38 29.84 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.744 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -126.79 124.44 39.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.834 0.35 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.538 ' HB2' ' CD2' ' A' ' 68' ' ' LEU . 0.0 OUTLIER -93.49 145.49 24.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.528 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.651 HG13 ' CA ' ' A' ' 67' ' ' GLY . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.506 HG23 ' CG ' ' A' ' 77' ' ' PHE . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.487 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.733 HD22 ' HG2' ' A' ' 52' ' ' GLN . 6.3 m-20 -132.99 -19.15 2.28 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.535 ' C ' ' O ' ' A' ' 89' ' ' ASN . 29.7 m0 5.3 101.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.821 0.7 . . . . 0.0 112.52 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.458 ' HB1' ' HG3' ' A' ' 112' ' ' ARG . . . -54.53 135.5 62.82 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.182 179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.1 -31.91 11.53 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.482 2.122 . . . . 0.0 112.332 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -127.48 86.7 0.33 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.478 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -156.43 97.47 2.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.87 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.19 107.83 1.63 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.565 2.177 . . . . 0.0 112.345 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -75.6 138.66 41.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.924 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 55.9 m -91.04 156.01 18.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -111.39 130.74 55.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . 0.42 ' HB2' ' OD2' ' A' ' 119' ' ' ASP . 0.4 OUTLIER -159.17 -49.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.58 176.49 6.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.883 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -114.6 42.27 1.97 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.548 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.67 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -79.67 -161.15 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.845 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.422 ' HB3' ' ND2' ' A' ' 70' ' ' ASN . 0.4 OUTLIER -166.46 97.39 0.58 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.005 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -156.45 150.74 25.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.441 HG21 ' CD1' ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.473 ' SD ' ' HB3' ' A' ' 120' ' ' ARG . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.638 ' HE2' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER -122.65 136.12 54.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.635 ' N ' ' HE1' ' A' ' 107' ' ' MET . 0.5 OUTLIER 178.08 174.26 0.57 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.722 -179.806 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 95.76 -93.63 1.59 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.799 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.593 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 66.3 m -104.01 -19.78 14.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.754 0.311 . . . . 0.0 111.17 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.561 ' HA2' ' HE2' ' A' ' 107' ' ' MET . . . 129.99 20.44 1.32 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.469 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.593 ' HD3' ' HB2' ' A' ' 110' ' ' SER . 0.0 OUTLIER -117.13 -159.61 0.74 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.61 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.442 ' O ' ' C ' ' A' ' 117' ' ' PHE . . . -156.57 162.15 39.92 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.442 ' C ' ' O ' ' A' ' 116' ' ' ALA . 14.0 m-85 -33.45 -76.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.885 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.67 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.0 OUTLIER 166.86 40.89 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.627 178.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.42 ' OD2' ' HB2' ' A' ' 99' ' ' SER . 2.3 m-20 -72.14 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.473 ' HB3' ' SD ' ' A' ' 106' ' ' MET . 4.8 tpt180 -57.99 149.28 23.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -119.63 127.95 53.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.981 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.494 ' HA ' ' HB ' ' A' ' 62' ' ' THR . 4.5 mp -90.47 -156.61 0.44 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.577 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.71 HG13 HG22 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.495 ' N ' HG12 ' A' ' 126' ' ' VAL . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.448 HD22 ' N ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.566 ' HB3' ' HB2' ' A' ' 19' ' ' CYS . . . -66.57 81.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.1 p -132.0 22.38 4.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.998 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.585 ' HA ' ' HB ' ' A' ' 7' ' ' THR . 62.9 m 59.52 -174.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.021 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 89.97 5.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.34 113.47 3.48 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.519 2.146 . . . . 0.0 112.312 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.15 106.97 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.624 2.216 . . . . 0.0 112.268 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -68.41 97.02 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.07 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.6 p -81.51 168.85 17.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 55.15 61.89 2.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.017 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.68 113.48 4.83 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.438 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 80.4 p -72.18 144.78 48.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.79 0.329 . . . . 0.0 110.849 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.69 83.18 6.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.835 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.73 0.3 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.88 -153.06 24.98 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -80.92 155.21 26.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.4 m -73.15 -174.64 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.7 m 55.38 76.64 0.26 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.878 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.58 43.24 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.105 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t -90.47 1.8 56.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.876 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.663 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.534 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.499 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.688 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.673 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.621 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.481 ' N ' HD21 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.592 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.673 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.688 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm -130.89 162.76 28.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.0 -126.8 9.01 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.596 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 56.81 -165.51 0.14 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.821 0.343 . . . . 0.0 111.233 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -124.48 -82.58 0.64 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -119.01 -165.8 1.18 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.974 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.56 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.496 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.496 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.556 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.679 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.679 ' N ' ' HG3' ' A' ' 42' ' ' GLN . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.799 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.562 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.75 HG22 HD23 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . 0.642 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.449 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.636 ' HB2' HG21 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.674 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.546 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.449 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.75 HD23 HG22 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 -64.5 -32.06 73.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -73.23 98.22 2.59 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.887 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 m -61.81 -83.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.999 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -112.6 6.57 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.805 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 20.6 p -132.01 110.61 10.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.83 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.539 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -55.29 172.32 1.27 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.824 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.767 ' HB2' HG23 ' A' ' 126' ' ' VAL . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.676 ' NE1' HD12 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.799 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.624 ' CA ' HG13 ' A' ' 80' ' ' VAL . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.732 HD11 HD12 ' A' ' 66' ' ' ILE . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.56 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -85.18 161.99 19.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.431 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 10.4 mt -84.01 88.26 7.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.274 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.7 OUTLIER 67.82 -81.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.889 -179.538 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.31 39.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.671 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -84.91 -18.35 34.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.239 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 104.59 4.75 42.9 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.844 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.28 125.1 53.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.6 ' CD2' HG21 ' A' ' 105' ' ' VAL . 3.2 m-85 -99.58 151.29 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.642 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.624 HG13 ' CA ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.522 ' HA ' ' NE1' ' A' ' 79' ' ' TRP . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.412 ' HB3' ' CG1' ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.741 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 -146.84 -11.07 0.45 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.466 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -34.1 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.779 0.323 . . . . 0.0 111.115 -179.771 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 64.13 146.01 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.325 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.96 -23.48 34.47 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.589 2.193 . . . . 0.0 112.278 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 159.58 18.48 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.53 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.99 87.57 23.03 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.697 0.284 . . . . 0.0 110.857 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 118.62 5.79 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.468 2.112 . . . . 0.0 112.341 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.3 141.76 57.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.0 t -65.4 -45.26 84.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.901 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -97.19 133.07 42.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.4 m -109.26 131.34 55.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.851 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -86.61 3.09 45.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.859 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . 0.715 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 128.96 -173.05 19.49 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.599 ' HB2' ' HE1' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -162.57 121.33 2.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.723 0.297 . . . . 0.0 110.854 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.521 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 7.9 t70 -167.51 -25.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.217 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -153.88 147.97 25.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 -179.99 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.6 HG21 ' CD2' ' A' ' 77' ' ' PHE . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.439 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.52 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER -121.9 145.51 48.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.474 ' HB3' ' H ' ' A' ' 109' ' ' GLY . 0.0 OUTLIER -155.46 -98.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.542 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.474 ' H ' ' HB3' ' A' ' 108' ' ' ARG . . . -86.05 174.93 48.0 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.919 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.474 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 15.3 m 59.89 10.72 2.24 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.739 0.305 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 53.98 42.2 70.07 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.555 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.484 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -148.88 -156.24 0.7 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.741 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.466 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -154.44 162.14 41.32 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.715 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 34.5 t80 -47.84 -90.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.121 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 120' ' ' ARG . 0.1 OUTLIER 170.63 50.62 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.827 0.346 . . . . 0.0 110.528 179.74 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.76 21.06 0.42 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.508 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.401 ' H ' ' C ' ' A' ' 118' ' ' CYS . 0.0 OUTLIER 55.6 97.66 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.853 0.358 . . . . 0.0 111.103 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -130.26 -9.32 4.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.365 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.676 HD12 ' NE1' ' A' ' 65' ' ' TRP . 2.0 mp -97.86 -172.92 2.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.432 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 64' ' ' SER . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.455 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.406 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.405 ' N ' HD23 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -46.43 157.63 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.1 m -94.36 91.64 6.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.77 -174.09 3.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -130.74 96.6 22.86 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.847 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -53.76 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 -179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 97.26 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.593 2.195 . . . . 0.0 112.268 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 -165.99 0.14 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.256 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -153.44 -16.45 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.58 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.034 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.15 124.48 28.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.52 146.21 54.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 110.965 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.41 -167.49 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.184 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.91 -179.966 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.899 0.381 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.1 -176.64 42.0 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -70.07 149.24 47.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 t -94.18 -77.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 13.6 t 62.61 163.45 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.177 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 71.43 64.57 0.15 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.033 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.438 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t -71.57 2.43 5.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.371 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.733 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.472 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.622 ' HA ' ' HE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.733 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.557 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.579 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -129.37 161.26 30.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.01 -123.83 8.01 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.781 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.517 HG23 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 58.33 -165.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.806 0.336 . . . . 0.0 111.158 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.25 -71.86 0.51 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.296 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -125.79 -172.87 2.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.284 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.504 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.517 ' HB3' HG23 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.504 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.458 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.554 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.415 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.479 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.565 HD23 ' HA2' ' A' ' 67' ' ' GLY . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.817 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.663 ' N ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.8 HG21 HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.422 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' CB ' HG23 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.627 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.627 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.8 HD22 HG21 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.605 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.501 ' N ' HG23 ' A' ' 56' ' ' THR . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 -66.28 -31.42 72.21 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.501 ' HB1' ' HE3' ' A' ' 107' ' ' MET . . . -85.45 89.58 7.73 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.953 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.04 -82.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -112.83 16.71 19.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.728 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.42 ' HB ' ' C ' ' A' ' 123' ' ' GLY . 17.7 p -137.62 100.71 4.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.58 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -52.15 172.77 0.29 Allowed Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.986 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.446 ' CZ2' ' HB2' ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.817 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.713 ' CA ' HG11 ' A' ' 80' ' ' VAL . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.613 HD23 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER -89.87 157.82 17.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.21 -94.95 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.409 -179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.32 -78.48 0.33 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.165 -179.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 102' ' ' GLU . 0.0 OUTLIER -154.25 -83.75 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 pttt -76.43 7.54 4.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.221 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.8 -126.85 0.13 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.594 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -127.7 145.64 50.83 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.613 ' CD1' HD23 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -87.44 151.82 22.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.567 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.596 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.713 HG11 ' CA ' ' A' ' 67' ' ' GLY . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.567 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.552 HG22 ' O ' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.422 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.579 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 -136.79 -33.81 0.77 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.412 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 25.64 45.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 178.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.545 ' HA ' ' HD3' ' A' ' 112' ' ' ARG . . . 58.9 169.5 0.07 OUTLIER Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 120.487 0.184 . . . . 0.0 111.14 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.92 ' HD3' ' HG2' ' A' ' 112' ' ' ARG . 31.3 Cg_endo -63.26 -30.19 73.77 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.247 1.964 . . . . 0.0 112.316 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 134.54 33.78 0.29 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.68 81.37 18.42 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.679 0.276 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -56.96 115.71 2.69 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.626 2.217 . . . . 0.0 112.27 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -70.38 148.02 48.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.7 m -63.33 -46.13 88.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.17 83.69 7.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.93 165.07 28.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.061 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -150.53 -163.66 1.83 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.635 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -57.33 154.67 19.79 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.307 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 7.2 mt-10 -90.07 166.35 13.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.903 0.383 . . . . 0.0 111.403 -179.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.562 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 4.8 t0 -172.6 -28.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.502 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m -154.08 148.59 26.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.798 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.596 HG13 ' CE3' ' A' ' 113' ' ' TRP . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.51 ' HB2' HD22 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.501 ' HE3' ' HB1' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.63 129.8 51.22 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -166.15 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 64.77 -105.9 1.32 Allowed Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.738 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.402 ' HB2' ' CG ' ' A' ' 112' ' ' ARG . 5.7 m -83.84 35.57 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.57 0.224 . . . . 0.0 111.199 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.528 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 55.12 36.03 60.77 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.157 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.92 ' HG2' ' HD3' ' A' ' 92' ' ' PRO . 1.4 ppt_? -132.64 -149.94 0.4 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.596 ' CE3' HG13 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.404 HD21 ' HE1' ' A' ' 106' ' ' MET . 3.7 m-20 -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.74 161.87 39.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -40.69 149.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.048 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.2 OUTLIER -73.58 68.11 1.15 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.972 0.415 . . . . 0.0 111.075 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.99 -2.55 3.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.55 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 120' ' ' ARG . 9.2 mmt180 -68.72 143.54 54.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.697 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.0 92.81 4.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.58 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.2 mp -85.04 -146.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.274 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.42 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.439 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.702 HG13 HG22 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . 0.415 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.54 140.12 2.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.409 ' HB ' ' HB ' ' A' ' 7' ' ' THR . 2.0 m -97.7 128.49 44.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.967 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -149.08 6.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.89 139.94 14.59 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.82 114.5 3.89 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.636 2.224 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.57 103.54 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.511 2.141 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -119.28 -61.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.038 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.2 m -83.53 169.86 15.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.853 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 119.05 20.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.18 -156.58 7.24 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.45 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 68.4 m 59.49 -89.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.27 107.73 2.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.954 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 119.14 115.67 2.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.487 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -112.73 -9.03 13.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.418 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 4.4 t -112.0 -21.3 5.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 8.6 m -60.77 98.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -169.37 41.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -87.96 6.65 34.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.799 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.764 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.54 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.513 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.764 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.584 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.5 t-20 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.407 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.565 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.646 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.648 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.465 ' O ' ' HB2' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp -126.02 151.12 47.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.537 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 151.88 121.53 0.94 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.425 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.61 ' HB ' HH12 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -62.96 127.49 31.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 111.082 -179.785 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.475 ' HD3' ' HZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -172.64 -149.24 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.811 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -127.18 174.35 8.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.923 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.457 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.568 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.482 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.649 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.416 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.532 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.59 HD21 ' HA2' ' A' ' 67' ' ' GLY . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.87 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.657 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.774 HG23 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.446 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.674 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.622 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.774 HD21 HG23 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.674 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.441 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 -66.89 -29.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -61.23 96.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.241 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 m -84.84 93.03 8.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.742 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.01 15.86 5.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 -179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.453 ' HB ' ' C ' ' A' ' 123' ' ' GLY . 4.2 p -149.45 106.09 3.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.687 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.496 ' HA2' ' SD ' ' A' ' 107' ' ' MET . . . -53.22 168.71 1.01 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.942 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.461 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.645 ' NE1' HD12 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.87 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.686 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.722 HD11 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . 0.457 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.552 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -89.76 155.3 19.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -74.19 80.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.799 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.28 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.895 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.97 34.97 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.74 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -18.22 59.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.56 9.49 57.64 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.805 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.56 124.97 39.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.719 0.259 . . . . 0.0 110.378 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.615 ' HE1' ' HE1' ' A' ' 79' ' ' TRP . 0.3 OUTLIER -93.87 150.01 20.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 -179.567 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.572 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.615 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.686 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.572 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.572 HG23 ' CD1' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.401 ' HB3' ' CE2' ' A' ' 77' ' ' PHE . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.604 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 -142.48 -31.5 0.52 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.474 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 18.56 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.11 110.84 0.95 Allowed Pre-proline 0 N--CA 1.464 0.242 0 CA-C-O 120.681 0.277 . . . . 0.0 111.489 179.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.75 128.17 23.68 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.656 2.237 . . . . 0.0 112.261 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 92.91 12.14 58.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.477 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -114.13 88.83 15.6 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.627 0.251 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.63 116.89 4.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.557 2.171 . . . . 0.0 112.292 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.5 p -74.28 131.24 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.67 -179.27 6.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -107.04 121.79 45.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.76 -169.22 2.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.837 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -126.69 128.18 46.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.39 -143.11 5.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . 0.558 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.3 OUTLIER -83.74 -153.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.742 0.306 . . . . 0.0 110.906 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.19 98.13 0.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.8 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -157.13 158.3 36.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 -179.723 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.452 HG23 ' HA ' ' A' ' 115' ' ' ASP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' MET . . . . . 0.442 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.517 ' HE3' ' HA ' ' A' ' 108' ' ' ARG . 0.4 OUTLIER -121.04 142.65 49.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.517 ' HA ' ' HE3' ' A' ' 107' ' ' MET . 18.3 ptt85 173.15 -178.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.044 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.58 -120.61 5.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.83 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.492 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 66.8 m -66.82 -30.73 70.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 111.245 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.61 0.5 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.798 -179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.492 ' NE ' ' HB2' ' A' ' 110' ' ' SER . 1.1 ptp180 -126.73 -149.91 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.623 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.452 ' HA ' HG23 ' A' ' 105' ' ' VAL . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.57 162.18 39.92 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 116' ' ' ALA . 48.8 m-85 -33.36 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.472 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . 0.558 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.2 OUTLIER 162.44 -88.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 122.554 0.342 . . . . 0.0 110.661 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 54.39 37.09 26.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.61 HH12 ' HB ' ' A' ' 26' ' ' THR . 0.0 OUTLIER 60.6 122.06 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.946 0.403 . . . . 0.0 111.306 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.64 -32.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.631 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.645 HD12 ' NE1' ' A' ' 65' ' ' TRP . 2.6 mp -85.36 -172.05 3.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.453 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.475 ' HZ3' ' HD3' ' A' ' 27' ' ' LYS . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.713 HG13 HG22 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.452 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.416 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.407 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.36 152.68 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 m -94.59 98.22 10.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . 0.418 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.5 OUTLIER -121.82 97.49 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.9 m -74.91 115.82 48.05 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.811 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.72 137.55 35.84 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.485 2.124 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.49 3.94 4.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.622 2.214 . . . . 0.0 112.404 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.39 -166.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.218 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -67.56 164.78 18.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.6 -49.85 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.79 120.39 8.81 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 p -140.66 -59.64 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.32 72.36 1.61 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.009 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.808 0.337 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.09 118.34 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.552 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 59.71 -89.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.718 0.294 . . . . 0.0 111.181 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.503 HG11 HG22 ' A' ' 132' ' ' THR . 14.6 m -60.21 153.88 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.235 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.4 p -124.05 -8.77 7.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 73.4 66.83 0.1 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.07 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.592 HG23 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t -77.8 13.41 1.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.346 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.78 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.491 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.534 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' TRP . . . . . 0.78 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.531 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.607 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.401 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.673 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.687 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.497 ' HA2' ' HZ2' ' A' ' 11' ' ' LYS . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm -114.55 160.6 19.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.467 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -175.68 -161.77 25.61 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.659 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.22 81.82 0.13 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.962 0.411 . . . . 0.0 110.801 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.525 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 22.7 mmtm -153.57 -139.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.525 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 47.5 mt-30 -119.61 -177.62 3.42 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.593 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.593 ' HG3' ' O ' ' A' ' 30' ' ' VAL . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.421 ' HB3' ' HE2' ' A' ' 39' ' ' MET . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.421 ' HE2' ' HB3' ' A' ' 38' ' ' ASP . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLN . . . . . 0.5 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' N ' ' HG2' ' A' ' 42' ' ' GLN . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.878 HG22 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.656 ' N ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.748 HG21 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.506 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.5 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.446 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.748 ' HB2' HG21 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.649 ' HG2' HD22 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.446 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.687 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . 0.634 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.485 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.534 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 -66.78 -30.92 71.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.13 109.74 7.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.013 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.36 -28.92 18.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.024 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -69.22 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.916 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.06 -55.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.449 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -163.87 -170.7 29.15 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.49 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.462 ' HH2' ' H ' ' A' ' 27' ' ' LYS . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.878 ' HA ' HG22 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.734 ' CA ' HG12 ' A' ' 80' ' ' VAL . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.658 ' HB2' HG13 ' A' ' 66' ' ' ILE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASN . . . . . 0.668 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 4.8 t-20 -89.65 158.72 17.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.23 -8.67 18.17 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.77 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -152.7 26.92 0.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.573 0.225 . . . . 0.0 111.301 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' A' ' 100' ' ' GLN . 2.7 mp 59.28 -87.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.41 -2.28 55.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.724 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.54 -108.84 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.502 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.9 124.78 38.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 0.0 110.592 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.63 ' HA ' ' HA ' ' A' ' 70' ' ' ASN . 0.1 OUTLIER -86.83 151.71 23.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 -179.414 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . 0.531 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.734 HG12 ' CA ' ' A' ' 67' ' ' GLY . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.412 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.531 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' O ' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.419 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASN . . . . . 0.667 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 52.9 m-20 -132.06 -33.83 1.31 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.463 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.2 m0 21.3 99.08 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.512 ' HB3' ' HD3' ' A' ' 112' ' ' ARG . . . -41.08 142.04 0.92 Allowed Pre-proline 0 N--CA 1.462 0.16 0 CA-C-O 120.7 0.286 . . . . 0.0 111.488 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.1 -7.45 21.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.518 2.146 . . . . 0.0 112.252 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -72.96 -108.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.435 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -145.0 85.93 7.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.769 0.318 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.52 -3.18 12.96 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.596 2.197 . . . . 0.0 112.311 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 135.58 53.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 t -146.27 163.76 34.48 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.18 95.6 5.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.925 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 m -161.59 -178.64 6.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.887 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLN . . . . . 0.413 ' HA ' HD12 ' A' ' 73' ' ' LEU . 3.1 tt0 -152.76 135.25 15.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 138.21 -144.37 15.56 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.46 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -88.24 99.88 12.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.668 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 6.8 t70 -73.95 163.42 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.43 153.02 36.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.785 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.571 HG11 ' CE3' ' A' ' 113' ' ' TRP . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' MET . . . . . . . . . . . . . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' MET . . . . . 0.518 ' HE3' HE21 ' A' ' 52' ' ' GLN . 0.0 OUTLIER -121.1 130.41 53.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.4 ' O ' ' HD2' ' A' ' 112' ' ' ARG . 0.0 OUTLIER 176.75 -166.8 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.798 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.49 ' HA3' ' CZ ' ' A' ' 112' ' ' ARG . . . 83.98 -54.81 4.98 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.744 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 52.0 m -154.69 -11.55 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.632 0.253 . . . . 0.0 111.237 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . 0.57 ' CA ' HG22 ' A' ' 56' ' ' THR . . . 127.38 14.87 2.57 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.169 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ARG . . . . . 0.512 ' HD3' ' HB3' ' A' ' 91' ' ' ALA . 0.8 OUTLIER -112.83 -153.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TRP . . . . . 0.667 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.77 161.28 39.79 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -48.86 156.81 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.945 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.26 64.86 4.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.078 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . 0.401 ' OD1' ' HG2' ' A' ' 120' ' ' ARG . 3.1 p30 -97.78 -15.57 20.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.628 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 120' ' ' ARG . 0.6 OUTLIER -99.58 -162.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.647 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 121.95 4.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.451 ' HB3' ' H ' ' A' ' 123' ' ' GLY . 6.1 mp -85.48 -152.67 0.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.575 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLY . . . . . 0.451 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.516 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' TRP . . . . . 0.467 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.532 HG23 ' CD1' ' A' ' 22' ' ' PHE . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . 0.439 ' N ' HD21 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ALA . . . . . 0.592 ' HA ' HG23 ' A' ' 7' ' ' THR . . . -60.18 -2.5 0.45 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' THR . . . . . 0.503 HG22 HG11 ' A' ' 4' ' ' VAL . 19.0 p -94.6 127.85 40.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.997 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 3.1 p -85.58 3.55 40.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.7 t -132.52 129.38 21.4 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.01 117.61 5.22 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.587 2.191 . . . . 0.0 112.339 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.55 -4.59 15.32 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.574 2.183 . . . . 0.0 112.348 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.21 -168.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.246 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.67 165.81 24.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.906 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.67 -61.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -142.38 -32.69 0.11 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.7 m 59.34 -90.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.661 0.267 . . . . 0.0 111.077 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -97.75 67.9 2.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.126 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.869 -179.926 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.784 0.326 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.811 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.811 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.1 t30 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.42 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.613 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.756 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.756 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA2' ' HD2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.884 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.711 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.785 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.495 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.599 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.667 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.495 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.785 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 C--O 1.229 -0.203 0 N-CA-C 112.759 -0.136 . . . . 0.0 112.759 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.884 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.729 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.892 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.587 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.892 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.993 0.425 . . . . 0.0 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.443 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.795 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.437 ' N ' HG12 ' A' ' 85' ' ' VAL . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.404 ' O ' ' ND2' ' A' ' 89' ' ' ASN . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 6.1 m120 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.865 0.364 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.675 HG23 HD12 ' A' ' 68' ' ' LEU . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.638 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.638 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.512 0.196 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.627 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HD2' ' HA2' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.695 0.283 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.833 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.833 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.7 t30 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.405 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.89 ' HB3' HD22 ' A' ' 43' ' ' LEU . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.74 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.548 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.89 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.686 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.89 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.576 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.606 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.89 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.599 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.484 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.56 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.89 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.528 ' N ' HD13 ' A' ' 68' ' ' LEU . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.89 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 121.06 0.457 . . . . 0.0 110.354 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.685 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.04 0.448 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.64 HG23 HD12 ' A' ' 68' ' ' LEU . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.576 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.456 ' SD ' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.685 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.576 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.506 0.193 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.625 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.548 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.697 0.284 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.812 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.452 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.719 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.812 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.4 t30 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.736 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.818 0.342 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.836 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.765 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.765 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.511 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.836 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.838 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.847 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.484 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.637 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.481 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.847 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.499 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.674 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.192 0 CA-C-O 120.812 0.118 . . . . 0.0 112.857 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.66 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.949 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.609 ' N ' HD13 ' A' ' 68' ' ' LEU . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.539 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 34.3 t30 . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.949 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.004 0.431 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.709 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.458 ' N ' HG12 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.4 ' O ' ' ND2' ' A' ' 89' ' ' ASN . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 6.4 m120 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.914 0.388 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.736 HG23 HD12 ' A' ' 68' ' ' LEU . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.682 ' HB2' HD21 ' A' ' 122' ' ' LEU . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.441 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.45 ' HD3' ' O ' ' A' ' 113' ' ' TRP . 2.5 ppt_? . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.5 mp . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.47 0.176 . . . . 0.0 110.603 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.448 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.609 HG22 ' CD1' ' A' ' 22' ' ' PHE . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.512 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.802 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.75 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.629 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.497 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.624 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.861 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.861 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.877 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.678 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.794 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.619 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.644 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.794 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.44 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.594 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.577 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.877 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.678 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.956 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.956 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.471 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 85' ' ' VAL . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.683 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.724 HG23 HD12 ' A' ' 68' ' ' LEU . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.664 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.451 ' CE ' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.709 ' HE1' HD12 ' A' ' 46' ' ' ILE . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 106' ' ' MET . 6.0 mp . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.464 0.173 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.613 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' OD1' ' A' ' 14' ' ' ASN . . . . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.735 0.303 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.744 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.6 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.0 t30 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.438 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.885 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.862 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.862 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.885 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.875 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.666 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.895 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.479 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.625 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.479 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.895 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.677 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.199 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.445 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.642 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.875 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.697 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.895 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.953 0.406 . . . . 0.0 110.687 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.711 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 85' ' ' VAL . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 . . . . . 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.73 HG23 HD12 ' A' ' 68' ' ' LEU . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.725 ' HB2' HD21 ' A' ' 122' ' ' LEU . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.542 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.614 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.4 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.591 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.48 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.731 0.3 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.784 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.784 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.598 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.514 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.93 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.522 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.524 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.93 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.9 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.703 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.814 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.473 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.501 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.814 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.236 0 N-CA-C 112.737 -0.145 . . . . 0.0 112.737 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.522 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.9 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.703 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.836 HD12 HG23 ' A' ' 105' ' ' VAL . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.582 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.561 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.577 ' HE1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.577 HG22 ' HE1' ' A' ' 79' ' ' TRP . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.545 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.724 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.7 m120 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.836 HG23 HD12 ' A' ' 68' ' ' LEU . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.691 ' HB3' HD11 ' A' ' 122' ' ' LEU . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.439 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 16.4 ptt180 . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.724 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.511 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.691 HD11 ' HB3' ' A' ' 106' ' ' MET . 5.5 mp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.587 0.232 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.829 0.347 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.704 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.736 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.579 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.0 t30 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.403 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.85 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.785 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.665 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.521 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.85 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.86 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.706 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.482 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.577 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.661 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.661 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.482 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 . . . . . 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.702 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.247 0 N-CA-C 112.902 -0.079 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.626 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.86 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.706 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.787 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.586 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.566 HG22 ' NE1' ' A' ' 79' ' ' TRP . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.438 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.73 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 . . . . . 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 68' ' ' LEU . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.523 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.455 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 6.5 ptp180 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.73 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.702 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.436 0.16 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.594 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.407 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.665 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.797 0.332 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.783 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.783 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.8 t30 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.68 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.877 ' HA ' HD13 ' A' ' 43' ' ' LEU . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.877 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.689 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.88 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.51 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.586 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.2 pp0? -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.711 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.604 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 46' ' ' ILE . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.689 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.891 HD13 HG21 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.505 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.57 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 3.0 t30 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.584 ' NE1' HG22 ' A' ' 85' ' ' VAL . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.732 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' NE1' ' A' ' 79' ' ' TRP . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.592 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.982 0.42 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.891 HG21 HD13 ' A' ' 68' ' ' LEU . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.654 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.711 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.592 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.654 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.7 mp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.643 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.432 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.726 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.521 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.726 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.639 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.513 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.633 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.661 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.658 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.468 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.584 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.517 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.922 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.712 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.766 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.601 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.613 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.613 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.766 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.572 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.516 -0.233 . . . . 0.0 112.516 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.662 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.922 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.712 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.574 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.484 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 2.1 m120 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.958 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.455 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.757 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' N ' HG12 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.692 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.894 0.378 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.701 HG23 HD12 ' A' ' 68' ' ' LEU . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.912 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.567 ' HB2' ' O ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.912 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.9 mp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.47 0.176 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.428 ' N ' HD23 ' A' ' 130' ' ' LEU . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.78 0.324 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.857 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.46 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.857 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.3 t30 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.651 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.724 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.858 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.731 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.534 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.866 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.647 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.674 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.654 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.8 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.458 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.724 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.654 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.527 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.54 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.665 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.866 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.713 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.974 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.974 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.424 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.745 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 85' ' ' VAL . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.4 ' O ' ' ND2' ' A' ' 89' ' ' ASN . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.69 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 5.8 m120 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.775 HG23 HD12 ' A' ' 68' ' ' LEU . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.821 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.54 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.475 ' HD2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.69 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.583 0.23 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.615 HG12 ' CG2' ' A' ' 44' ' ' VAL . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.534 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.504 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.785 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.714 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.652 0.263 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.936 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.53 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.905 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.735 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.743 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.542 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.663 ' O ' ' HB ' ' A' ' 56' ' ' THR . 1.9 pp0? -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.548 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.743 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.45 -0.375 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.905 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.735 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.979 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.485 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.767 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.557 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.728 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.599 HG21 ' CD2' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.728 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.1 m120 . . . . . 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 23.9 m . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.979 HG21 HD13 ' A' ' 68' ' ' LEU . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.504 ' CB ' HD11 ' A' ' 122' ' ' LEU . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.728 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.598 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.5 mp . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.49 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.634 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.666 0.27 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.479 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.476 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.514 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.868 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.873 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.687 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.827 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.426 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.512 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' HB2' HG22 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.587 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.822 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.241 0 CA-C-O 120.873 0.152 . . . . 0.0 112.974 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.407 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.658 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.873 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.687 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.917 HD11 ' HB2' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.62 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.917 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.415 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.474 ' HE1' HG22 ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.707 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.415 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.68 ' CG2' HD21 ' A' ' 68' ' ' LEU . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.691 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.1 m120 . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.699 HG23 HD12 ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.706 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.511 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 112' ' ' ARG . 3.6 ptp180 . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.691 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 106' ' ' MET . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.706 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.441 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG22 ' CD1' ' A' ' 22' ' ' PHE . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.533 ' C ' ' HD3' ' A' ' 9' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.056 0 CA-C-O 120.616 0.246 . . . . 0.0 111.087 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.594 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.723 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.589 HD11 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.1 t30 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.723 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.831 0.348 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 65' ' ' TRP . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.56 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.868 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.825 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.654 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.893 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.632 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.9 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.465 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.884 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.668 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.893 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.725 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.925 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.588 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.7 t30 . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.925 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.028 0.442 . . . . 0.0 110.589 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.671 HG11 ' CB ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' N ' HG12 ' A' ' 85' ' ' VAL . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 5.4 m120 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.011 0.434 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.709 HG23 HD12 ' A' ' 68' ' ' LEU . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.813 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.813 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.451 0.167 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.459 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.606 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.41 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.646 0.26 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.79 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.536 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.465 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.544 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.79 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.612 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.0 t30 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.665 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.79 0.329 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.9 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.897 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.897 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.731 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.9 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.83 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.624 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.91 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.544 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.643 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.2 pp0? -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.874 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.544 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.604 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.701 -0.159 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.493 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.624 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.69 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.799 HD12 HG23 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.629 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.555 ' HE1' HG22 ' A' ' 85' ' ' VAL . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.686 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.629 HG21 ' CD2' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.44 ' C ' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 2.9 m120 . . . . . 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.927 0.394 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.799 HG23 HD12 ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.515 ' HE3' ' HB3' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 105' ' ' VAL . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.624 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.8 mp . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.635 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.624 HG12 ' CG2' ' A' ' 44' ' ' VAL . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.731 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.706 0.289 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.814 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.814 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.543 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.4 t30 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 18' ' ' LYS . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.422 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.678 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.892 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.892 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.898 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.734 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.762 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.408 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.52 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.483 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.664 ' HB2' HG22 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.649 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.8 pp0? -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.762 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.649 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.481 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 . . . . . 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.646 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.92 -0.072 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.494 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.648 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.898 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.734 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.738 HD12 HG23 ' A' ' 105' ' ' VAL . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.594 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.575 ' HE1' HG22 ' A' ' 85' ' ' VAL . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.798 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.427 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.553 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.738 HG23 HD12 ' A' ' 68' ' ' LEU . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.941 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.539 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.645 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.941 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.69 0.281 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.641 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.684 0.278 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.813 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.813 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.0 t30 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.416 ' H ' ' H ' ' A' ' 18' ' ' LYS . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.709 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.668 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.744 0.306 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.873 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.736 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.742 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.727 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.63 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.0 pp0? -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.475 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.742 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.478 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.642 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.459 ' OG ' HD13 ' A' ' 55' ' ' LEU . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.62 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.88 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.736 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.962 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.475 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.792 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.547 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.533 HG22 ' CD1' ' A' ' 79' ' ' TRP . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.471 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.642 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 0.8 OUTLIER . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.962 HG21 HD13 ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.763 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.528 ' HB2' ' O ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.528 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.642 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 105' ' ' VAL . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.763 HD21 ' HB2' ' A' ' 106' ' ' MET . 4.5 mp . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.78 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.595 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . . . . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.71 0.291 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.725 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.627 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.496 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.725 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.755 0.312 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.574 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.498 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.846 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.568 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.673 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.846 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.628 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.917 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.596 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.675 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.537 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.474 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.917 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.675 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.67 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.186 0 N-CA-C 112.824 -0.111 . . . . 0.0 112.824 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.493 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.717 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.859 HG22 HD11 ' A' ' 46' ' ' ILE . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.634 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.771 HD21 HG22 ' A' ' 85' ' ' VAL . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.574 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 68' ' ' LEU . 3.2 m-85 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.662 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.771 HG22 HD21 ' A' ' 68' ' ' LEU . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.64 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.755 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.638 HG21 HD13 ' A' ' 68' ' ' LEU . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.789 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.505 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.755 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.479 HD21 ' HA ' ' A' ' 114' ' ' ASN . 0.5 OUTLIER -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 106' ' ' MET . 2.0 mp . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.48 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.588 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.418 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.464 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.65 0.262 . . . . 0.0 111.371 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.574 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.3 t30 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.666 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.79 0.329 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.894 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.888 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.743 ' H ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.861 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.438 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.531 ' CB ' HG22 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.617 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.617 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.861 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.59 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.17 0 CA-C-O 120.814 0.119 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.61 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.888 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.743 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.902 HD21 ' CE1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.566 ' N ' HD13 ' A' ' 68' ' ' LEU . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.902 ' CE1' HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.571 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.762 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.571 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.901 HG22 ' CD1' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.603 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.707 HG23 HD12 ' A' ' 68' ' ' LEU . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.587 ' HB2' HD11 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.451 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 1.4 ppt_? . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.645 ' CE3' HG11 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.401 HD21 ' HA ' ' A' ' 114' ' ' ASN . 0.5 OUTLIER -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.2 mp . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.489 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.62 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ARG . . . . . 0.425 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.791 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.791 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.601 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.0 t30 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.653 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.723 0.297 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.956 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.546 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.956 HD13 ' HA ' ' A' ' 33' ' ' ARG . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.936 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.746 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.772 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.454 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.506 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.681 ' HB2' ' HE1' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.612 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.772 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.667 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.661 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.207 0 N-CA-C 112.942 -0.063 . . . . 0.0 112.942 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.48 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.732 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.936 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.746 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.474 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.719 ' CZ ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.639 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.678 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.57 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.719 HG13 ' CZ ' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.618 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.441 HG11 ' CE3' ' A' ' 113' ' ' TRP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.804 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.511 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.681 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.804 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.6 mp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' TRP . . . . . 0.486 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.609 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.514 HG22 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.581 0.229 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.805 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.462 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.542 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' TRP . . . . . 0.805 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.625 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.4 t30 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.402 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.696 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.603 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.939 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.739 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.739 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.939 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.954 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.721 ' H ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.528 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.514 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.719 ' HB2' HG22 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.655 ' O ' ' HB ' ' A' ' 56' ' ' THR . 1.7 pp0? -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.718 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.655 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.542 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.454 -0.258 . . . . 0.0 112.454 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.577 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.602 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.954 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.778 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.583 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASN . . . . . 0.667 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.903 ' CD1' HG22 ' A' ' 85' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.429 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.538 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.903 HG22 ' CD1' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.412 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASN . . . . . 0.684 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 2.9 m120 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.976 0.417 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.721 HG23 HD12 ' A' ' 68' ' ' LEU . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' MET . . . . . 0.459 ' CB ' HD11 ' A' ' 122' ' ' LEU . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' MET . . . . . 0.577 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ARG . . . . . 0.465 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 0.8 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TRP . . . . . 0.684 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.602 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.1 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.458 0.17 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.658 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.418 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' HG22 ' A' ' 7' ' ' THR . . . . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.791 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.67 54.82 0.27 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -78.39 147.05 34.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.4 m -72.85 -171.99 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.046 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 133' ' ' CYS . 94.5 m -102.44 -92.56 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -177.73 74.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.793 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' A' ' 132' ' ' THR . 2.9 t -89.37 3.53 51.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.974 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.811 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.811 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.1 t30 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.42 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -114.37 160.51 19.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.499 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -174.23 -164.83 29.85 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.59 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.03 87.51 0.37 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.773 0.321 . . . . 0.0 110.799 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.415 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 9.4 mmtt -162.95 -142.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -115.43 -176.95 3.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.613 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.756 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.756 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA2' ' HD2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.884 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.711 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.785 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.495 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.599 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.667 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.495 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.785 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 -64.42 -32.91 74.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.446 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -73.33 100.23 3.12 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.003 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -60.06 -71.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 15.2 p80 -130.32 16.08 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.854 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.446 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 10.8 p -139.56 114.97 9.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -56.99 175.22 1.47 Allowed Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.759 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.884 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.729 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.892 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.587 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.501 HD21 ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -86.98 149.93 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.14 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.086 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -110.2 -75.15 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.805 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.6 HD21 ' HA2' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -152.96 -76.99 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.791 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.99 7.62 12.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.048 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.84 -130.15 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.603 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.33 143.39 50.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.8 0.333 . . . . 0.0 110.755 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.892 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -81.78 124.39 29.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.488 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.443 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.795 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.437 ' N ' HG12 ' A' ' 85' ' ' VAL . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.44 ' HB3' ' HE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 6.1 m120 -139.97 -14.78 1.03 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -35.07 112.19 0.14 Allowed 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -178.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.504 ' HB2' ' HD2' ' A' ' 112' ' ' ARG . . . -28.89 115.3 0.28 Allowed Pre-proline 0 N--CA 1.464 0.272 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.938 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -57.63 -66.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.634 2.223 . . . . 0.0 112.311 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -99.79 85.37 0.64 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.493 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -120.82 81.75 34.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.678 0.275 . . . . 0.0 110.956 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.22 142.61 87.07 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.572 2.182 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.6 40.86 31.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.959 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.07 25.4 0.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.885 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -136.31 -17.5 1.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -106.92 83.97 1.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.966 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -166.18 -33.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.6 ' HA2' HD21 ' A' ' 73' ' ' LEU . . . 155.59 164.03 12.76 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.387 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.422 ' HA ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.8 131.92 11.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.729 0.3 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.435 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 3.3 t70 -169.02 -29.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 140.11 36.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.452 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.675 HG23 HD12 ' A' ' 68' ' ' LEU . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.638 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.436 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.12 129.68 51.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 168.86 -160.31 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.659 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.67 -109.76 2.97 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.922 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.9 m -81.69 37.17 0.46 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.696 0.284 . . . . 0.0 111.224 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.557 ' O ' HG21 ' A' ' 56' ' ' THR . . . 57.94 30.18 63.02 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.495 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.504 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 1.0 OUTLIER -133.13 -146.14 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 -179.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.422 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -156.25 161.99 40.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -40.9 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.688 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 32.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.759 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -95.5 -10.15 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.718 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -61.65 113.82 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.18 92.33 8.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.062 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.638 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.34 -159.18 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.503 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.499 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.627 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HD2' ' HA2' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.471 ' O ' HG23 ' A' ' 132' ' ' THR . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -45.06 124.51 4.59 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 130' ' ' LEU . 21.5 p -131.75 -169.0 2.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 5' ' ' CYS . 84.0 m -100.64 -172.34 2.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.2 p -141.51 97.61 6.68 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.849 ' HG2' ' HB2' ' A' ' 138' ' ' SER . 47.2 Cg_endo -68.7 154.45 71.31 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.495 2.13 . . . . 0.0 112.253 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.84 -8.63 24.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.555 2.17 . . . . 0.0 112.323 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.06 -42.48 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.114 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.849 ' HB2' ' HG2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -74.0 -177.58 2.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 123.08 21.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.877 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -134.98 -102.43 0.71 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.499 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.0 t -124.17 -65.17 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.25 35.57 26.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.238 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.922 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 p . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.796 0.331 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.23 -150.59 22.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.468 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -72.7 151.12 42.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.805 0.336 . . . . 0.0 110.849 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.508 HG23 ' H ' ' A' ' 5' ' ' CYS . 0.2 OUTLIER -126.44 -58.43 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.148 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' H ' HG23 ' A' ' 4' ' ' VAL . 2.4 m 55.01 47.48 22.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -168.21 66.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.895 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -91.1 2.8 56.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.898 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.833 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.833 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.7 t30 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.405 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm -121.27 153.92 37.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 161.41 126.81 0.84 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.528 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.2 m -93.63 115.8 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.769 0.319 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.518 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -167.18 -143.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.818 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -116.04 175.86 5.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 27' ' ' LYS . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.89 ' HB3' HD22 ' A' ' 43' ' ' LEU . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.74 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.548 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.89 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.686 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.89 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.576 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.606 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.89 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.854 HG21 ' HA2' ' A' ' 111' ' ' GLY . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.484 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 -63.95 -33.47 75.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.878 ' HB3' ' HE1' ' A' ' 107' ' ' MET . . . -85.02 103.42 14.03 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.1 m -80.09 88.07 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.024 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.0 m80 54.97 30.31 13.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.59 -41.03 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.874 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 85.01 146.93 8.54 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.48 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.56 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.89 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.528 ' N ' HD13 ' A' ' 68' ' ' LEU . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.572 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 2.9 m120 -64.13 155.54 31.21 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.11 -22.17 58.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.765 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -156.33 -77.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.822 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.489 HD23 ' HA2' ' A' ' 101' ' ' GLY . 0.7 OUTLIER -149.93 -78.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.858 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.458 ' H ' ' HG2' ' A' ' 74' ' ' LYS . 6.2 pttp -101.47 7.81 42.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.89 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.27 -113.25 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.707 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -127.29 137.21 52.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.989 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.89 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -74.83 127.32 32.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.354 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.685 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 -140.45 -20.13 0.85 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.698 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.96 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.131 0.491 . . . . 0.0 111.499 -179.241 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 62.62 149.87 0.1 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.395 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.15 -17.03 45.38 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.511 2.141 . . . . 0.0 112.292 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 145.96 86.22 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.446 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.44 112.11 1.37 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.607 0.241 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.0 110.38 2.59 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.525 2.15 . . . . 0.0 112.305 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.79 131.17 42.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.1 p -105.36 14.5 28.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 13.0 ptt-85 -143.51 41.87 1.48 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.96 -73.83 0.35 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.956 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.64 45.24 25.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.975 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 73' ' ' LEU . . . -177.77 -103.7 0.17 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.524 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 6.6 mt-10 60.5 96.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 0.0 111.131 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.572 ' HA ' ' HB2' ' A' ' 70' ' ' ASN . 33.9 t70 -137.61 -23.1 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.794 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.9 144.62 31.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.555 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.64 HG23 HD12 ' A' ' 68' ' ' LEU . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.576 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.878 ' HE1' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.75 130.72 52.95 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 108' ' ' ARG . 0.4 OUTLIER -109.1 165.85 11.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.222 -179.549 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.94 -13.85 57.81 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.516 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -52.95 -31.61 41.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.835 0.35 . . . . 0.0 110.781 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.854 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 118.12 21.44 4.13 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.709 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -163.17 -164.68 0.98 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.685 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.698 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.78 39.95 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 103' ' ' ASP . 27.9 t80 -41.31 -78.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.696 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.32 32.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.718 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -95.24 -10.5 30.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.704 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 120' ' ' ARG . 20.4 mmt180 -63.4 112.31 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.11 93.94 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.576 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.23 -162.96 0.77 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.544 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.625 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.548 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.07 -167.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.14 -164.11 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.003 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 57.67 37.09 27.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.883 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 p -87.6 137.39 32.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.65 123.62 10.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.53 2.153 . . . . 0.0 112.292 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -55.99 111.37 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.589 2.193 . . . . 0.0 112.23 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.47 -35.11 15.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.8 p -152.65 -60.36 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.23 115.86 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.18 126.78 8.44 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.445 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 127.86 34.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.873 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.29 96.16 2.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.131 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.891 179.997 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.805 0.336 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.91 -97.34 0.24 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.492 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -81.83 154.42 25.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.6 m -70.63 161.87 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.108 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 55.96 29.84 14.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -171.26 52.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t -91.89 9.66 31.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.812 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.452 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.719 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.812 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.4 t30 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.736 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt -134.07 153.24 51.93 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.9 -126.86 8.15 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.823 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.811 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.0 -162.74 0.23 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.704 0.288 . . . . 0.0 111.177 -179.831 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.84 -78.21 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.365 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -121.15 -171.85 2.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.276 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.811 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.836 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.765 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.765 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.511 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.836 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.838 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.847 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.484 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.637 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.481 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.847 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.499 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -66.06 -32.01 73.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -84.51 96.32 9.1 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.01 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -60.67 -77.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.885 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -118.49 9.33 12.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 26.6 p -126.44 101.69 6.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.674 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -52.69 169.48 0.71 Allowed Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.857 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.66 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.949 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.609 ' N ' HD13 ' A' ' 68' ' ' LEU . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.757 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 34.3 t30 -89.31 148.36 23.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.3 mt -47.06 -82.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.459 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -112.62 -78.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.077 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.506 HD21 ' HD2' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -146.43 -56.39 0.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.811 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -101.2 7.46 43.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.39 -135.39 0.14 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.46 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -123.29 133.16 54.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.949 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -72.0 120.52 17.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.351 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.709 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.458 ' N ' HG12 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 6.4 m120 -140.54 -13.16 1.0 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -40.16 107.91 0.08 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.057 0.456 . . . . 0.0 111.319 -179.178 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.458 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . . . -48.76 113.17 2.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.276 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.53 -12.34 20.56 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.731 2.287 . . . . 0.0 112.379 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.89 19.45 16.38 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.567 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.77 72.15 9.65 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 110.953 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.32 110.71 3.12 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.539 2.159 . . . . 0.0 112.422 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.45 144.94 32.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.82 169.68 22.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.957 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 58.33 -172.66 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.056 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.1 85.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.064 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -79.11 133.21 36.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 -134.26 2.7 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.462 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -167.87 0.89 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.749 0.309 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.757 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 0.3 OUTLIER -164.48 112.33 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.989 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m -143.34 152.18 41.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.359 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.736 HG23 HD12 ' A' ' 68' ' ' LEU . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.682 ' HB2' HD21 ' A' ' 122' ' ' LEU . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.461 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.78 129.52 50.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.64 -162.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.6 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.38 -111.21 3.97 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.034 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' HG3' ' A' ' 112' ' ' ARG . 3.1 m -80.66 39.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.644 0.259 . . . . 0.0 111.335 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.585 ' O ' HG21 ' A' ' 56' ' ' THR . . . 56.7 30.2 59.14 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.415 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.458 ' NE ' ' HB2' ' A' ' 91' ' ' ALA . 2.5 ppt_? -133.77 -146.93 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.454 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -144.28 161.96 37.6 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.506 ' HD2' HD21 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -74.47 28.63 0.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.454 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.454 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER 68.69 20.25 8.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.601 179.517 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.448 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 0.7 OUTLIER -92.74 -6.43 49.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.576 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -83.26 167.41 17.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.04 118.35 15.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.987 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.5 mp -94.22 -143.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.449 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.448 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.609 HG22 ' CD1' ' A' ' 22' ' ' PHE . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.512 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.53 -178.41 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 p -94.47 24.16 4.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m -98.2 30.07 3.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 81.8 p -75.19 120.18 80.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.38 115.43 2.44 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.528 2.152 . . . . 0.0 112.288 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 109.24 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.572 2.181 . . . . 0.0 112.346 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.29 117.59 13.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.063 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.52 -37.47 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -136.67 -28.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.11 123.13 12.1 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.451 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.45 125.56 27.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.827 0.346 . . . . 0.0 110.892 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.65 -40.03 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.146 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.878 179.989 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.835 0.35 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.08 -97.63 1.21 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -72.29 151.95 42.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.775 0.321 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 t -72.98 143.42 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.172 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 133' ' ' CYS . 48.7 t -164.26 65.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.42 57.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t -88.08 1.87 53.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.75 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.629 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.497 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.624 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt -126.46 162.81 24.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' HA3' ' CZ2' ' A' ' 125' ' ' TRP . . . 163.66 -145.46 10.5 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.631 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.37 107.71 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.807 0.337 . . . . 0.0 111.097 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.565 ' HD3' ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -166.12 -144.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.433 ' H ' ' HB2' ' A' ' 27' ' ' LYS . 1.6 mt-30 -121.11 -178.18 3.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.565 ' HB3' ' HD3' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.861 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.861 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.877 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.678 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.794 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.619 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.644 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.794 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.44 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 -65.37 -31.66 72.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.578 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -88.43 113.8 24.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.067 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -79.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -140.58 31.36 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.951 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.6 p -112.2 -53.68 2.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.594 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 106.06 158.23 22.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.463 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.577 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.877 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.678 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.956 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.09 156.67 17.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.5 80.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.38 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.83 29.68 0.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -76.32 -18.62 58.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.327 -179.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 105.59 -4.68 40.08 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.569 -0.824 . . . . 0.0 113.051 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.01 123.83 47.36 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.892 0.346 . . . . 0.0 110.375 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.956 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -100.0 130.77 46.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 -179.335 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.471 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 85' ' ' VAL . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.483 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.683 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 -140.79 -12.58 0.98 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.531 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -36.92 109.95 0.11 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.986 0.422 . . . . 0.0 111.152 -179.193 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -41.38 128.86 2.23 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.628 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.97 -33.73 1.42 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.683 2.255 . . . . 0.0 112.346 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -88.82 31.14 5.09 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.539 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.88 81.55 15.75 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.57 127.84 27.59 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.571 2.181 . . . . 0.0 112.342 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.7 p -73.94 128.53 35.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.858 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.05 6.24 45.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.907 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.2 OUTLIER 56.7 86.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.037 179.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.8 m -117.37 -166.51 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 119' ' ' ASP . 15.8 mm-40 -86.81 -175.2 5.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.827 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 122.61 -148.83 16.94 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.579 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.664 ' H ' ' HB2' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -142.26 -88.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.657 0.265 . . . . 0.0 111.044 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.18 103.51 0.87 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.922 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p -164.35 147.07 9.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.724 HG23 HD12 ' A' ' 68' ' ' LEU . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.664 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.578 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -125.3 129.93 50.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 108' ' ' ARG . 0.0 OUTLIER 171.76 -165.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.88 -179.865 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.73 -133.34 19.01 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.909 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.479 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 70.4 m -53.91 -24.8 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.74 0.305 . . . . 0.0 111.163 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.71 27.33 0.96 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.429 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -129.51 -148.45 0.37 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 -179.888 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.709 ' HE1' HD12 ' A' ' 46' ' ' ILE . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.487 ' HB3' HH12 ' A' ' 120' ' ' ARG . 20.4 m-20 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.7 39.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.419 ' HB3' ' N ' ' A' ' 102' ' ' GLU . 52.9 m-85 -44.32 -77.26 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.664 ' HB2' ' H ' ' A' ' 102' ' ' GLU . 0.1 OUTLIER 174.18 32.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.734 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.5 t70 -113.71 56.55 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.487 HH12 ' HB3' ' A' ' 114' ' ' ASN . 0.8 OUTLIER -126.35 -39.25 2.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.714 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' A' ' 28' ' ' GLN . 0.1 OUTLIER 58.87 99.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.101 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 106' ' ' MET . 6.0 mp -85.28 -153.62 0.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.66 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.53 ' CZ2' ' HA3' ' A' ' 25' ' ' GLY . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.613 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' OD1' ' A' ' 14' ' ' ASN . . . -51.87 179.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.05 5.95 50.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.133 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HB2' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -130.1 148.53 51.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.3 135.13 88.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.06 146.17 51.51 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.605 2.203 . . . . 0.0 112.255 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.44 99.91 0.74 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.526 2.15 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.07 113.38 10.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.131 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.9 t -118.4 -17.62 9.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . 0.477 ' HB3' ' H ' ' A' ' 140' ' ' GLY . 5.9 tt0 59.34 -89.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLY . . . . . 0.477 ' H ' ' HB3' ' A' ' 139' ' ' GLU . . . 112.02 -25.78 12.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.451 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.76 151.55 39.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 0.0 110.874 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -69.96 94.24 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.098 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.061 179.969 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.84 0.353 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.27 112.76 0.84 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.564 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.16 147.72 52.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -99.49 -75.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.113 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 53.3 45.95 27.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.956 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -169.11 84.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t -115.06 0.61 13.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.842 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.744 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.6 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.0 t30 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.438 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt -140.85 153.03 45.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.72 94.36 0.64 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.722 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.8 -156.99 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.703 0.287 . . . . 0.0 110.805 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.486 ' HB2' ' CG ' ' A' ' 31' ' ' HIS . 7.5 mmtp -112.98 -95.19 0.45 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.247 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.13 -167.78 1.56 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.486 ' CG ' ' HB2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.885 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.862 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.862 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.885 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.875 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.666 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.895 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.479 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.625 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.479 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.895 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -65.51 -32.16 73.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -78.83 99.03 6.55 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.023 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.5 m -63.07 -74.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 13.18 9.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.433 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 18.3 p -134.06 106.57 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.677 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -55.16 168.78 2.12 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.445 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.642 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.875 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.697 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 103' ' ' ASP . 0.1 OUTLIER -84.23 154.59 22.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -71.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.229 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.62 84.02 2.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.392 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 102' ' ' GLU . 5.6 mp 56.55 -89.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.35 7.43 14.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.636 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -164.71 3.28 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.388 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -88.32 132.5 34.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.844 0.354 . . . . 0.0 110.203 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.895 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -74.69 120.27 20.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.687 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.711 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 85' ' ' VAL . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.476 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 -140.41 -12.43 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -39.21 105.52 0.04 OUTLIER 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 111.031 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.95 124.04 1.6 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.592 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -83.76 -7.93 10.36 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.74 2.293 . . . . 0.0 112.435 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.96 15.59 31.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.622 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -137.74 72.43 49.05 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.776 0.322 . . . . 0.0 110.984 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -56.7 112.56 1.13 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.147 . . . . 0.0 112.277 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.01 122.76 21.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.4 m -130.49 -56.32 1.08 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.52 97.12 4.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 84.4 p -150.86 -171.88 4.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 -68.09 -22.13 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.954 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.91 -152.03 19.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.536 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 3.0 pt-20 -168.68 92.27 0.29 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.782 0.325 . . . . 0.0 110.876 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 36.8 t70 -116.04 -8.07 11.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.21 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m -149.26 151.9 35.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.73 HG23 HD12 ' A' ' 68' ' ' LEU . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.725 ' HB2' HD21 ' A' ' 122' ' ' LEU . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.542 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -124.76 129.07 49.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 166.3 170.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 110' ' ' SER . . . 65.1 120.89 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.565 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 1.1 m 69.19 -71.85 0.11 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.761 0.315 . . . . 0.0 110.983 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 160.02 30.44 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.797 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -137.08 -149.94 0.34 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.602 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.516 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -157.42 161.2 38.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.536 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 1.5 t80 -50.76 143.64 9.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.681 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -81.85 71.65 8.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.98 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.89 53.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.164 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.2 93.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.272 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -131.65 -12.03 3.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.451 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp -115.26 -162.29 0.82 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.614 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.4 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.591 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.48 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.55 154.46 0.45 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.6 m -94.62 90.81 6.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.907 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 7.5 t -139.91 18.57 2.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.1 m 56.17 73.91 0.77 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.008 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.526 ' HB2' ' HD3' ' A' ' 136' ' ' PRO . 74.8 Cg_exo -48.73 -47.91 19.43 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.712 2.275 . . . . 0.0 113.299 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 135' ' ' PRO . 40.1 Cg_exo -57.55 104.44 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.055 1.837 . . . . 0.0 112.285 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.04 107.21 3.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.071 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.61 172.25 5.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.917 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 127.68 32.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.908 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.3 122.37 15.13 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.1 p -70.0 134.98 48.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.7 -67.9 0.77 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.001 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.799 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.61 132.08 24.48 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -114.87 10.69 16.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 0.0 110.963 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 2.8 t -117.04 -21.1 5.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.022 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.562 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 1.8 m -61.7 107.76 0.88 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.4 29.71 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.903 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -89.84 5.54 45.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.784 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.784 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.598 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm -116.3 159.07 22.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.29 138.05 2.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.568 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.4 ' HB ' ' H ' ' A' ' 27' ' ' LYS . 18.7 p -77.2 -129.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.488 0.185 . . . . 0.0 110.761 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' H ' ' HB ' ' A' ' 26' ' ' THR . 15.6 mmtt 66.78 -163.81 0.23 Allowed 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 111.065 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -112.71 -167.9 1.25 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.514 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.93 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.522 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.524 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.93 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.9 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.703 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.814 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.473 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.501 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.814 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 -66.93 -31.2 71.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.458 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -77.36 98.81 5.35 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.967 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 m -59.06 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.959 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -119.78 11.2 11.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 9.5 p -133.57 113.75 12.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -56.52 172.31 2.06 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.737 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.522 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.9 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.703 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.836 HD12 HG23 ' A' ' 105' ' ' VAL . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.582 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.05 140.15 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.89 131.69 44.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.885 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.07 -90.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.039 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.09 -48.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 74' ' ' LYS . 13.7 pttt -101.35 7.67 42.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.023 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.01 -135.27 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.567 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -122.71 142.99 50.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.849 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.561 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.38 124.41 24.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.577 ' HE1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.577 HG22 ' HE1' ' A' ' 79' ' ' TRP . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.545 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.724 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.7 m120 -133.09 -6.67 3.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.534 ' C ' ' O ' ' A' ' 89' ' ' ASN . 27.0 m0 -12.48 108.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.631 0.582 . . . . 0.0 111.762 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -53.0 111.24 2.49 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.199 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD2' ' CZ ' ' A' ' 112' ' ' ARG . 35.8 Cg_exo -61.38 -30.08 86.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.652 2.234 . . . . 0.0 112.249 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.12 28.32 5.66 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -138.92 80.01 25.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.737 0.304 . . . . 0.0 110.831 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.42 118.78 5.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.678 2.252 . . . . 0.0 112.277 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.2 p -70.36 128.46 36.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.04 149.36 21.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.886 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 98' ' ' ARG . 4.0 ttt180 -76.8 115.2 16.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.52 -168.52 2.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.852 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -143.97 146.84 33.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.05 -97.56 0.12 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.691 ' H ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -120.6 -159.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 110.885 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -156.34 113.9 3.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.833 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.9 159.03 3.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.836 HG23 HD12 ' A' ' 68' ' ' LEU . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.691 ' HB3' HD11 ' A' ' 122' ' ' LEU . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.458 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.82 129.7 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 171.53 -157.06 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.039 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.26 -109.95 3.06 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.578 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.443 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 12.6 m -84.06 25.01 0.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.863 0.363 . . . . 0.0 110.815 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.506 ' O ' HG21 ' A' ' 56' ' ' THR . . . 71.91 29.3 67.31 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.542 ' CZ ' ' HD2' ' A' ' 92' ' ' PRO . 16.4 ptt180 -124.05 -148.0 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.724 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.511 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.03 162.76 39.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.691 ' HB3' ' H ' ' A' ' 102' ' ' GLU . 0.4 OUTLIER -50.07 -15.87 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.519 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.7 m 74.1 50.88 0.11 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.051 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.58 16.5 2.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.766 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.428 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 15.1 mtt85 -120.87 -32.22 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.995 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER 68.4 148.48 0.06 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.154 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.691 HD11 ' HB3' ' A' ' 106' ' ' MET . 5.5 mp -104.35 -155.42 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.919 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.562 ' HB1' ' HB3' ' A' ' 5' ' ' CYS . . . -46.71 156.15 0.21 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.4 m -94.47 85.61 4.6 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.761 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -127.3 144.37 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.957 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.46 80.07 8.57 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.742 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.27 112.21 2.93 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.559 2.173 . . . . 0.0 112.295 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.27 7.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.605 2.203 . . . . 0.0 112.448 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.34 110.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.8 p -76.34 178.19 6.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 55.98 35.85 26.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.046 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.88 115.29 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.487 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.2 p -144.24 -28.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.724 0.297 . . . . 0.0 110.875 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.68 28.89 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.243 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.902 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.834 0.35 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.14 -171.08 30.83 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.525 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -69.08 161.94 27.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 0.0 110.847 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.441 HG12 HG22 ' A' ' 132' ' ' THR . 3.2 t -105.09 -18.53 6.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 132' ' ' THR . 83.1 m -66.48 88.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -172.38 60.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.005 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.2 -6.54 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.91 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.704 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.736 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.579 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.0 t30 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.403 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt -139.25 153.22 47.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.1 100.02 0.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.754 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -158.01 -158.11 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 1.2 ttmt -112.61 -93.21 0.47 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.265 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.467 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 6.9 mt-30 -123.24 -169.78 2.0 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.85 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.785 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.665 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.521 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.85 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.86 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.706 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.482 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.577 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.661 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.661 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.482 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 -66.36 -30.82 71.29 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -84.08 93.01 8.02 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.899 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.59 -75.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -123.12 18.28 9.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.799 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.507 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 12.7 p -134.99 100.97 4.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.887 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.702 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -51.47 167.35 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.902 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.626 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.86 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.706 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 -87.38 149.64 24.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.42 -71.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.85 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -116.94 -173.46 2.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HG ' ' H ' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -65.21 -54.41 29.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.87 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.467 ' H ' ' HG ' ' A' ' 73' ' ' LEU . 35.3 mttm -101.15 7.72 43.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.843 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.9 -144.83 0.22 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.451 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -123.87 138.23 54.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.787 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -75.32 138.81 42.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.586 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.566 HG22 ' NE1' ' A' ' 79' ' ' TRP . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.438 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.73 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 -142.39 -8.05 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.55 ' C ' ' O ' ' A' ' 89' ' ' ASN . 31.5 m0 -9.33 103.74 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 O-C-N 123.409 0.443 . . . . 0.0 111.963 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -53.57 110.7 2.19 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.309 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.41 91.24 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.643 2.229 . . . . 0.0 112.137 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 156.55 -16.26 0.4 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.455 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.12 78.44 17.45 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.901 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.76 -10.66 26.8 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.534 2.156 . . . . 0.0 112.363 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.52 -166.51 0.12 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.922 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 96' ' ' THR . 20.7 m -101.88 -177.82 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.66 95.2 4.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.868 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -134.72 160.1 39.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -97.84 141.25 31.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.897 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.96 -137.9 6.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.549 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -69.36 164.55 22.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 0.0 111.007 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.471 ' CB ' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -148.38 113.28 5.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.663 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.493 ' N ' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -149.91 149.55 30.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 -179.533 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 68' ' ' LEU . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.523 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.51 130.61 52.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.63 -81.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.749 0.309 . . . . 0.0 111.694 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 112' ' ' ARG . . . -46.43 133.04 11.21 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.41 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.502 ' HB2' ' HD2' ' A' ' 112' ' ' ARG . 5.5 m 56.68 26.33 11.13 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.576 ' O ' HG21 ' A' ' 56' ' ' THR . . . 51.18 42.13 48.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.718 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.502 ' HD2' ' HB2' ' A' ' 110' ' ' SER . 6.5 ptp180 -142.78 -144.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.73 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -149.85 164.25 35.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.494 ' CD1' ' HB2' ' A' ' 119' ' ' ASP . 0.1 OUTLIER -69.0 29.55 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.941 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.498 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER 53.42 29.77 9.38 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 122.415 0.286 . . . . 0.0 111.709 179.373 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.494 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 18.1 t70 -77.26 -2.72 36.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.909 0.385 . . . . 0.0 110.781 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.53 -162.17 0.9 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.863 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -158.15 121.64 3.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.702 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp -88.91 -149.79 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.63 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.464 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.594 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.407 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.665 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -50.26 163.08 0.17 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.453 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 40.2 m -94.6 86.66 4.85 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.894 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.75 177.04 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 76.6 p -88.51 148.41 42.04 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.885 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 114.32 3.23 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.538 2.159 . . . . 0.0 112.239 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.13 105.36 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.552 2.168 . . . . 0.0 112.35 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -85.88 -66.95 0.85 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.069 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.98 139.59 39.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.828 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.65 149.12 50.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.874 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.84 118.7 9.14 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.525 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.3 p -107.95 -64.24 1.23 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 58.99 -90.72 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.279 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.859 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.827 0.346 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.99 94.53 1.97 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.503 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -92.16 122.65 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.2 m -118.52 -46.04 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.132 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -166.44 -165.49 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.983 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -145.33 57.79 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.855 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t -91.51 16.52 10.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.783 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.783 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.8 t30 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.68 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm -128.43 153.11 47.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.427 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 162.7 128.01 0.92 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.536 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.1 m -93.87 118.58 31.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.526 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -170.06 -141.76 0.03 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.669 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 40.3 mt-30 -117.75 173.54 6.68 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.877 ' HA ' HD13 ' A' ' 43' ' ' LEU . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.877 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.689 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.88 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.51 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.586 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.2 pp0? -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 -67.99 -30.52 69.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.496 ' HB1' ' H ' ' A' ' 63' ' ' GLY . . . -63.34 121.86 14.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.184 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 p -61.78 -45.38 94.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -94.49 12.94 25.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.785 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.83 50.81 13.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . -158.42 107.61 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.558 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.711 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.604 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 46' ' ' ILE . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.689 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.891 HD13 HG21 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.505 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.57 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 17.5 t-20 -84.9 152.77 23.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.05 -89.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.451 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.4 94.76 2.83 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.79 0.329 . . . . 0.0 111.385 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' HA3' ' A' ' 101' ' ' GLY . 4.1 mp 56.29 -92.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.63 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? -76.06 7.39 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.427 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.58 -171.86 10.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.429 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -99.89 135.28 41.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 0.0 110.473 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.69 120.44 16.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.584 ' NE1' HG22 ' A' ' 85' ' ' VAL . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.732 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' NE1' ' A' ' 79' ' ' TRP . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.592 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -88.51 -39.96 13.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.441 ' C ' ' O ' ' A' ' 89' ' ' ASN . 16.9 m0 26.0 85.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.692 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -56.41 123.48 56.22 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.124 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -84.72 0.48 8.99 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.76 2.307 . . . . 0.0 112.47 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -84.8 4.57 84.72 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.598 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.78 77.8 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.729 0.299 . . . . 0.0 110.97 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.47 97.52 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.596 2.197 . . . . 0.0 112.281 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.27 -165.78 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.042 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 96' ' ' THR . 5.0 t -150.77 -58.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.918 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -158.14 -55.08 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 26.1 p -156.3 24.39 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.573 ' HG2' ' HB1' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.86 92.74 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.996 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.482 ' HA3' HD23 ' A' ' 73' ' ' LEU . . . -69.4 148.92 47.94 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.436 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.433 ' N ' ' HA ' ' A' ' 73' ' ' LEU . 12.7 mt-10 -75.08 128.98 36.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.925 0.393 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -147.54 -33.99 0.26 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.361 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 144.32 30.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.038 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.891 HG21 HD13 ' A' ' 68' ' ' LEU . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.654 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.711 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.05 130.01 52.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 107' ' ' MET . 0.0 OUTLIER 176.67 -20.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.127 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -51.49 -70.89 0.75 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.742 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 m -150.34 47.15 0.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.786 0.326 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.443 ' O ' HG21 ' A' ' 56' ' ' THR . . . 91.38 -9.27 77.78 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.736 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.692 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 1.6 ptp180 -112.13 -154.82 0.55 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.592 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' A' ' 100' ' ' GLN . . . -157.18 161.5 39.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.79 160.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.664 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.91 71.71 1.55 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.898 0.38 . . . . 0.0 111.097 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -112.12 -32.18 6.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.371 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 148.76 37.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.478 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.33 108.91 17.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.085 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.654 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.7 mp -85.09 -163.56 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.544 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.643 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.432 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.03 87.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.7 p -131.97 109.91 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 2.2 m -83.18 -5.64 59.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.945 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.1 p -127.18 72.2 76.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.82 154.31 48.52 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.635 2.223 . . . . 0.0 112.292 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.93 87.06 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.539 2.159 . . . . 0.0 112.296 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.99 -14.13 32.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.141 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.8 m -70.94 132.45 45.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -89.29 4.24 49.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -71.7 97.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.72 102.75 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.859 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.16 -166.8 0.13 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.243 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.915 -179.979 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.7 74.7 0.4 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.52 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.81 145.6 28.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.714 0.293 . . . . 0.0 110.97 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 15.2 m -81.7 -173.68 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.067 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 60.2 m 55.07 69.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -165.34 50.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.024 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t -95.41 1.65 54.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.726 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.521 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.726 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.639 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.513 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.633 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.661 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.658 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER -114.37 161.02 18.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -172.57 -164.29 27.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.64 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.54 78.15 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 110.761 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 3.7 mmtp -154.24 -139.54 0.08 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.864 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.489 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 11.3 mt-30 -118.38 -175.04 2.79 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.468 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.402 ' CE1' ' HD2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.584 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.517 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.922 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.712 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.766 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.601 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.613 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.613 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.766 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.615 ' OG1' ' HE3' ' A' ' 107' ' ' MET . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -64.07 -31.37 72.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.524 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -65.73 108.82 2.22 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.024 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.6 m -62.09 -80.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.61 -60.49 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.524 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -76.14 -162.73 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.87 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -118.33 -166.83 13.83 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.662 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.922 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.712 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.574 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.689 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 2.1 m120 -67.5 151.71 46.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.8 -26.8 60.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.64 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.545 HD12 ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -158.44 -74.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.692 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.545 ' HG2' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -101.36 7.58 42.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.91 -115.15 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.693 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -127.48 129.06 46.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.37 . . . . 0.0 111.311 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.958 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -70.95 128.61 36.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.994 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.455 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.757 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' N ' HG12 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.456 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.692 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 -144.49 -20.92 0.53 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.41 109.83 0.09 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.098 0.475 . . . . 0.0 111.415 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.455 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . . . -46.9 114.25 2.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.33 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.61 -21.08 53.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.567 2.178 . . . . 0.0 112.332 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.24 27.37 6.23 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.482 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HD22 ' A' ' 114' ' ' ASN . 0.6 OUTLIER -128.66 79.15 74.86 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.818 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -56.77 129.82 36.62 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.612 2.208 . . . . 0.0 112.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.4 t -72.47 147.28 46.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.942 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.4 m -93.26 -71.47 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -158.31 156.73 31.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.3 m -162.05 171.74 17.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.07 -71.47 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.86 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.8 176.78 52.56 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.403 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.441 ' HB3' ' HG2' ' A' ' 69' ' ' ARG . 60.7 mt-10 -49.42 117.91 2.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.689 ' HB2' ' HB2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -73.23 177.18 5.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 150.12 37.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.701 HG23 HD12 ' A' ' 68' ' ' LEU . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.912 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.711 ' HE2' ' N ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -123.04 136.24 54.75 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.711 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER 178.28 135.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.814 -179.751 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 120.63 -123.14 5.47 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.78 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.5 m -58.9 -31.52 68.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.699 0.285 . . . . 0.0 111.242 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.432 ' O ' HG21 ' A' ' 56' ' ' THR . . . 131.95 26.67 0.68 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.524 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -128.81 -155.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.466 HD22 ' HG3' ' A' ' 94' ' ' GLU . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.545 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.76 40.07 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -38.1 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.164 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 170.54 33.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.607 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.6 59.73 0.69 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.07 -32.39 3.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.792 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.5 mttt 59.37 95.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.912 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.9 mp -85.38 -152.72 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.579 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.53 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.428 ' N ' HD23 ' A' ' 130' ' ' LEU . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -42.0 148.49 0.18 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.0 m -94.37 96.64 9.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.003 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.73 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 35.3 m -127.48 -179.48 4.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.4 t -68.01 142.32 95.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -68.73 140.41 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.555 2.17 . . . . 0.0 112.284 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.35 2.8 5.85 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.648 2.232 . . . . 0.0 112.311 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.46 79.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.148 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.4 p -82.57 155.78 24.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 56.02 37.66 29.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.977 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.7 131.47 10.44 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.513 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.77 -35.43 4.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.801 0.334 . . . . 0.0 110.916 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -111.53 69.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.896 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.758 0.313 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.12 -156.29 26.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.535 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.83 89.37 1.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.621 HG21 ' HB3' ' A' ' 131' ' ' ALA . 15.9 m -85.47 -162.74 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.29 -159.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.961 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -137.86 61.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.841 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t -89.21 11.82 17.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.93 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.857 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.46 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.857 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 15.3 t30 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.651 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.724 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt -130.92 155.72 46.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.97 -123.12 7.36 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.859 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.741 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER 59.44 -165.22 0.2 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.724 0.297 . . . . 0.0 111.159 -179.849 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -128.52 -78.01 0.56 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.225 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -122.87 -170.72 2.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.109 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.858 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.731 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.534 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.866 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.647 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.674 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.654 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.8 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.458 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.724 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.667 HG21 ' HA2' ' A' ' 111' ' ' GLY . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 -65.1 -32.4 74.09 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.56 108.83 4.52 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.031 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.33 2.41 28.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -98.54 -74.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.553 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 2.7 m -142.98 -38.72 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.527 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 171.26 -173.59 44.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.543 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.54 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.665 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.866 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.713 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.974 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.467 ' H ' ' HB2' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -88.99 149.22 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.98 -77.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.167 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -110.18 -77.16 0.6 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.973 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.7 -51.14 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -100.71 7.46 43.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.57 -127.27 0.73 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.443 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -127.15 142.97 51.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.974 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -81.38 124.89 29.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.3 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.424 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.745 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 85' ' ' VAL . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.508 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.69 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 5.8 m120 -138.68 -15.11 1.21 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.544 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -38.15 110.48 0.13 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-O 121.022 0.439 . . . . 0.0 111.149 -179.048 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.767 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . . . -42.5 134.44 2.69 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.512 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.18 -17.99 24.03 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.568 2.178 . . . . 0.0 112.276 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.93 12.87 58.67 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.493 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -126.44 76.65 73.4 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.669 0.271 . . . . 0.0 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.65 -11.82 28.4 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.611 2.207 . . . . 0.0 112.269 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 58.44 -174.71 0.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.466 ' H ' HG22 ' A' ' 96' ' ' THR . 0.5 OUTLIER -164.82 -172.98 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.867 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 57.71 -166.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.035 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -153.3 147.94 26.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.33 -174.92 4.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.817 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -100.19 -16.02 28.8 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.509 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.834 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 16.3 mm-40 -67.87 167.5 13.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.689 0.281 . . . . 0.0 110.825 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.467 ' HB2' ' H ' ' A' ' 70' ' ' ASN . 2.3 p-10 -172.65 106.75 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.092 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p -161.25 145.59 13.39 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.775 HG23 HD12 ' A' ' 68' ' ' LEU . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.821 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.54 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.14 130.76 53.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.56 -178.69 4.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.233 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -73.49 -17.96 79.22 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.568 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -56.01 -45.6 79.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.913 0.387 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.667 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 127.55 28.41 0.9 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.866 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.767 ' HD3' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -150.7 -159.33 1.02 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.69 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.48 161.64 40.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.697 ' HB3' ' HB2' ' A' ' 102' ' ' GLU . 16.5 m-85 -44.42 -75.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.834 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.5 OUTLIER 174.36 31.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.31 -27.53 27.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.573 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -68.0 124.06 22.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.706 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.8 107.71 19.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp -85.03 -162.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.734 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.43 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.615 HG12 ' CG2' ' A' ' 44' ' ' VAL . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.534 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.621 ' HB3' HG21 ' A' ' 4' ' ' VAL . . . -61.02 92.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.7 p -131.66 -173.53 3.15 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 11.2 m -137.77 -57.12 0.68 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 68.8 p -68.02 141.57 94.44 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 136' ' ' PRO . 58.7 Cg_endo -71.43 127.5 13.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.565 2.177 . . . . 0.0 112.353 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 135' ' ' PRO . 35.1 Cg_exo -57.59 96.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.56 2.173 . . . . 0.0 112.316 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.75 -166.0 0.13 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.185 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -172.33 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 55.43 35.57 25.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.987 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -81.48 117.92 4.52 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.486 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 m -73.22 127.39 32.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.868 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.82 87.48 3.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.06 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.857 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.725 0.298 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.3 -137.42 11.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.493 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.0 159.74 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.766 0.317 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.4 t -85.33 126.66 40.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.202 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.52 116.98 28.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.824 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -155.7 28.48 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.935 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t -89.78 4.8 48.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.902 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.504 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.785 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.714 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt -116.94 162.56 17.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.441 ' HA3' ' CE2' ' A' ' 125' ' ' TRP . . . 145.95 129.25 2.04 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.642 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.5 p -95.85 127.76 42.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.772 0.32 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -172.88 -143.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -115.74 171.42 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.714 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.936 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.53 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.905 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.735 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.743 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.542 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.663 ' O ' ' HB ' ' A' ' 56' ' ' THR . 1.9 pp0? -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.548 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.743 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 -66.42 -30.79 71.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.45 114.12 5.86 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.039 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.09 5.48 38.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.998 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.17 -75.64 0.59 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.866 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.5 m -147.26 -40.75 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.841 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -178.16 -176.44 46.12 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.491 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.905 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.735 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.979 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.485 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 -89.07 148.75 23.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.828 ' HB2' ' HB2' ' A' ' 74' ' ' LYS . 10.2 mt -54.5 176.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.108 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -60.59 80.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.955 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.57 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 2.9 mp 50.22 25.71 1.9 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.989 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.828 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 27.3 mttt -76.63 -18.81 58.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.233 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.434 ' HA2' ' OE2' ' A' ' 102' ' ' GLU . . . 94.6 -3.82 68.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.37 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -111.42 122.92 49.12 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 117.198 0.499 . . . . 0.0 110.85 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.767 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -90.17 142.06 28.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.557 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.728 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.599 HG21 ' CD2' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.728 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.1 m120 -128.51 -24.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.477 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.6 m0 16.36 101.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.452 ' HB1' ' HB2' ' A' ' 94' ' ' GLU . . . -49.53 108.78 1.05 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.354 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -67.37 126.52 15.06 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.769 2.313 . . . . 0.0 112.24 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 60.59 25.87 63.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.534 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.452 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 6.2 mt-10 -136.6 73.87 54.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.687 0.28 . . . . 0.0 110.789 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.32 -75.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.525 2.15 . . . . 0.0 112.312 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.67 33.79 20.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.988 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.5 p -142.31 112.88 7.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -72.87 -28.98 62.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.861 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.2 m -86.17 109.29 18.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.05 -41.36 92.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -70.7 134.09 23.69 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.399 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -106.22 149.73 26.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.938 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.438 ' HA ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -136.46 -24.07 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.671 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.417 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 23.9 m -154.97 158.48 39.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.084 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.979 HG21 HD13 ' A' ' 68' ' ' LEU . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.504 ' CB ' HD11 ' A' ' 122' ' ' LEU . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.09 130.43 53.75 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.3 mtp180 -88.89 166.7 13.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.2 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.33 -22.63 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.318 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.619 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 48.0 m -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.356 . . . . 0.0 110.679 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.513 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 116.16 35.28 1.24 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.952 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.619 ' HD3' ' HB2' ' A' ' 110' ' ' SER . 0.0 OUTLIER -150.18 -163.85 1.88 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.728 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.08 161.28 39.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.501 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 17.4 t80 -41.57 135.88 2.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.629 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.0 OUTLIER -78.64 66.98 4.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.134 -179.725 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.2 -0.93 16.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.5 mmt180 -92.72 -161.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.806 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 21.9 ttmt -154.4 115.98 4.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.021 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.598 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.5 mp -85.54 -139.61 0.08 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.552 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.49 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' CE2' ' HA3' ' A' ' 25' ' ' GLY . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.634 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.45 -166.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 36.69 1.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.38 64.23 1.47 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.5 t -108.05 141.58 23.44 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.26 120.36 8.16 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.573 2.182 . . . . 0.0 112.293 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.84 104.22 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.545 2.164 . . . . 0.0 112.281 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.34 -65.46 1.01 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.076 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -111.69 153.58 26.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -70.01 123.85 22.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -109.28 -27.79 4.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.475 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 4.7 p -157.88 -43.22 0.06 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.766 0.317 . . . . 0.0 110.86 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.95 -164.98 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.247 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.863 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.17 177.23 23.96 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.879 -0.676 . . . . 0.0 112.544 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.04 168.42 17.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.757 0.313 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.17 126.1 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -141.5 87.62 2.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -173.2 83.65 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -3.36 11.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.479 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.6 t30 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt -140.79 153.14 45.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 90.75 87.41 1.38 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.568 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.27 -159.66 1.04 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.685 0.278 . . . . 0.0 110.82 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.5 ' HG2' ' HG3' ' A' ' 28' ' ' GLN . 4.0 ttmm -113.06 -90.88 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.2 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG3' ' HG2' ' A' ' 27' ' ' LYS . 44.2 mt-30 -123.22 -170.76 2.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.476 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.514 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.868 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.873 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.687 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.827 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.426 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.512 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' HB2' HG22 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.587 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.822 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 -68.67 -30.47 69.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.6 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -78.77 86.13 4.72 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.086 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.58 -53.3 4.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -51.57 59.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.964 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.6 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -150.53 161.97 41.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.928 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -59.61 178.99 2.15 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.974 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.407 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.658 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.873 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.687 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.917 HD11 ' HB2' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.62 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -96.23 139.07 32.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.7 129.06 38.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.146 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 55.85 -97.01 0.07 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.171 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -163.18 -39.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.844 0.354 . . . . 0.0 111.002 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 7.6 42.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.15 -136.63 1.6 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.518 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.21 147.11 50.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.71 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.917 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -73.79 132.72 42.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.415 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.474 ' HE1' HG22 ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.707 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.415 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.68 ' CG2' HD21 ' A' ' 68' ' ' LEU . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.691 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 3.1 m120 -131.64 -23.09 2.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.493 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.8 m0 13.33 101.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.581 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -54.34 124.21 46.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.704 0.288 . . . . 0.0 111.036 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -84.02 15.53 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.685 2.257 . . . . 0.0 112.493 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.04 -2.39 90.63 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.562 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.67 79.33 9.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.742 0.306 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.17 -48.11 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.544 2.163 . . . . 0.0 112.214 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 47.1 p -91.74 142.19 27.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.5 p -157.64 141.71 16.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.991 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.62 -2.36 56.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.4 p -118.78 127.69 53.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -102.29 27.48 6.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.36 125.56 7.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.516 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HG3' ' HA ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.57 104.46 2.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.834 0.35 . . . . 0.0 110.833 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -127.38 -21.88 3.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 24.1 m -154.95 158.18 38.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.699 HG23 HD12 ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.706 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.511 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -124.91 129.56 50.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 107' ' ' MET . 2.7 ptm180 171.87 -159.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.033 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.18 -107.78 1.86 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.649 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.467 ' HB2' ' CD ' ' A' ' 112' ' ' ARG . 6.6 m -84.96 29.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.844 0.354 . . . . 0.0 111.041 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.54 ' O ' HG21 ' A' ' 56' ' ' THR . . . 65.46 30.82 78.46 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.4 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.581 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 3.6 ptp180 -127.47 -148.24 0.38 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.691 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 106' ' ' MET . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.57 ' HA ' ' HG3' ' A' ' 102' ' ' GLU . . . -157.93 161.25 38.19 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -43.93 128.22 5.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.039 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.5 OUTLIER -75.14 77.52 2.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.99 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.86 55.37 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.129 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.464 ' HD2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.57 96.77 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.544 179.604 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.48 -14.66 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.961 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.706 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.1 mp -114.69 -161.6 0.78 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG22 ' CD1' ' A' ' 22' ' ' PHE . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -52.78 170.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.811 HG23 ' HG2' ' A' ' 136' ' ' PRO . 75.5 m -94.41 103.82 15.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.957 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.403 ' H ' ' H ' ' A' ' 134' ' ' THR . 0.1 OUTLIER -166.58 -10.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.849 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.562 ' H ' ' HD2' ' A' ' 135' ' ' PRO . 0.0 OUTLIER -162.08 -52.49 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.411 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 134' ' ' THR . 71.0 Cg_exo -48.16 -47.98 17.97 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.33 2.02 . . . . 0.0 113.208 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.811 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.7 Cg_exo -56.55 137.74 81.88 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.046 1.831 . . . . 0.0 112.314 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.2 40.13 30.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.207 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 -64.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 56.33 40.76 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.051 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.75 117.12 4.34 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.458 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.16 -53.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -104.57 27.19 8.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.957 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.866 0.365 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.67 -60.58 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.551 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.86 121.33 33.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.749 0.309 . . . . 0.0 110.975 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.3 t -107.45 -51.92 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.098 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -150.53 -96.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.897 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.479 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 1.8 t-20 -175.98 52.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.856 0.36 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.533 ' C ' ' HD3' ' A' ' 9' ' ' PRO . 0.7 OUTLIER -87.35 1.23 53.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.594 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.723 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.589 HD11 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 11.1 t30 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.723 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp -131.79 155.57 47.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.54 -125.34 8.22 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.907 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.729 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.32 -164.77 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.715 0.293 . . . . 0.0 111.043 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.36 -76.99 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.338 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -122.17 -170.4 2.06 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.165 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 65' ' ' TRP . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.729 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.56 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.868 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.825 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.654 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.893 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.632 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.9 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.465 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.884 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 -66.19 -31.88 72.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.4 96.2 0.08 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.103 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.4 p -96.82 50.36 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -153.89 -71.66 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.858 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.2 OUTLIER -146.64 -36.81 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.896 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 169.04 -172.86 43.46 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.57 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.668 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.893 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.725 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.925 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.588 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.7 t30 -93.92 138.05 32.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 146.63 39.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.038 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.04 -93.69 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.076 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 102' ' ' GLU . 0.2 OUTLIER -167.45 -54.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.842 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -101.23 7.64 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.13 -133.22 0.11 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.653 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -118.73 146.31 44.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.735 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.925 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -79.61 122.15 26.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 -179.722 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.671 HG11 ' CB ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' N ' HG12 ' A' ' 85' ' ' VAL . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.515 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 5.4 m120 -136.94 -15.26 1.54 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.626 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -39.85 102.58 0.03 OUTLIER 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.11 0.481 . . . . 0.0 111.206 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.25 120.71 10.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.447 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.58 -5.87 8.04 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.842 2.361 . . . . 0.0 112.421 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.47 11.27 52.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.596 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -129.39 72.24 81.98 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.3 116.24 3.07 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.622 2.214 . . . . 0.0 112.315 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.6 p -73.69 126.74 31.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.918 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.12 -29.66 0.76 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.869 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -31.03 70.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.941 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.1 t -158.3 156.73 31.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -128.86 153.41 47.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.552 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 175.0 -77.74 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.457 ' H ' ' N ' ' A' ' 117' ' ' PHE . 22.4 mt-10 60.84 100.81 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.908 0.385 . . . . 0.0 111.158 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 117' ' ' PHE . 34.8 t70 -149.26 -27.34 0.28 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.623 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -140.79 145.22 36.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.275 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.709 HG23 HD12 ' A' ' 68' ' ' LEU . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.813 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.31 132.09 54.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.79 -174.88 2.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.05 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.67 -10.55 58.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.672 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 58.8 m -59.44 -42.65 92.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.765 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.604 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 127.86 -8.72 6.81 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.787 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -127.15 -155.64 0.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.62 40.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.552 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 30.8 t80 -41.76 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.81 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.95 31.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.84 -15.68 23.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.579 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -63.12 122.55 16.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.702 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.3 102.39 14.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.813 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.18 -153.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.587 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.459 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.606 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.41 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 132' ' ' THR . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.88 118.04 2.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.523 ' O ' ' HB ' ' A' ' 7' ' ' THR . 19.9 p -131.46 -160.04 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.987 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.453 ' H ' ' HB ' ' A' ' 132' ' ' THR . 1.9 t -126.24 107.74 10.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.71 114.59 27.83 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.029 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.0 140.56 28.62 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.543 2.162 . . . . 0.0 112.313 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.08 92.48 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.505 2.137 . . . . 0.0 112.36 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.24 87.32 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.0 p -73.94 177.57 5.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 55.72 39.35 30.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.52 14.16 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.484 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' SER . . . . . 0.415 ' O ' ' HG2' ' A' ' 143' ' ' GLU . 0.7 OUTLIER -78.37 -171.69 2.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.901 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.74 96.35 0.4 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.13 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 141' ' ' SER . 8.2 pt-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.787 0.327 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.17 -37.83 0.14 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.494 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.82 145.56 34.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.904 0.383 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.3 t -104.56 -48.68 9.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.108 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.0 t -143.19 -101.36 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.971 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -176.5 50.52 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.902 0.382 . . . . 0.0 110.833 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t -84.11 0.85 46.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.095 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.79 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.536 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.465 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.544 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.79 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.612 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.0 t30 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.665 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm -129.48 155.65 45.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.77 -125.59 7.84 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.851 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.8 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER 59.9 -166.32 0.19 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.852 0.358 . . . . 0.0 111.169 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -126.3 -78.89 0.59 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.243 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -121.63 -171.09 2.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.8 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.9 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.897 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.897 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.731 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.9 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.83 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.624 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.91 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.544 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.643 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.2 pp0? -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.874 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.544 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 -69.1 -32.12 71.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.88 -1.84 15.76 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.65 -148.48 0.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -54.66 -31.99 58.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.113 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.602 HG21 ' HA3' ' A' ' 123' ' ' GLY . 0.0 OUTLIER -76.94 -169.4 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.604 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -123.58 175.98 16.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.701 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.493 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.624 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.69 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.799 HD12 HG23 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.534 ' ND2' ' HG3' ' A' ' 102' ' ' GLU . 13.9 t-20 -95.09 135.12 37.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mt -98.94 157.7 16.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.076 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 58.07 20.06 6.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.824 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 3.6 mp 59.71 -85.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -77.37 7.55 5.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.21 -125.06 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -127.26 146.77 50.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.998 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.629 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -75.29 135.32 40.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.555 ' HE1' HG22 ' A' ' 85' ' ' VAL . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.686 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.629 HG21 ' CD2' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.44 ' C ' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 2.9 m120 -127.42 -31.89 2.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.485 ' C ' ' O ' ' A' ' 89' ' ' ASN . 30.5 m0 22.01 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.478 0.486 . . . . 0.0 112.017 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.808 ' HB2' ' HB2' ' A' ' 112' ' ' ARG . . . -49.36 114.66 4.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.661 0.267 . . . . 0.0 111.296 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.06 109.92 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.572 2.181 . . . . 0.0 112.285 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 149.47 -32.46 1.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.535 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -124.6 78.62 63.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.322 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.3 -7.85 22.17 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.598 2.199 . . . . 0.0 112.419 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 116' ' ' ALA . 11.2 p 51.07 34.83 11.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.097 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.1 p -80.7 154.91 27.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.875 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 56.59 29.26 15.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.0 m -132.9 -168.98 2.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.839 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -63.08 145.94 54.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.824 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -64.15 140.29 43.33 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.516 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 2.1 pm0 -66.43 148.89 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.895 0.379 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -136.69 -26.35 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.83 154.33 38.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.52 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.799 HG23 HD12 ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.515 ' HE3' ' HB3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.18 130.5 53.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 179.63 -164.94 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.753 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.92 -58.94 5.02 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.545 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.543 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 51.6 m -155.14 -1.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.634 0.254 . . . . 0.0 111.141 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.629 ' O ' HG21 ' A' ' 56' ' ' THR . . . 121.99 8.94 7.05 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.329 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.808 ' HB2' ' HB2' ' A' ' 91' ' ' ALA . 1.3 mpt_? -104.8 -156.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 105' ' ' VAL . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.645 ' HB2' HG21 ' A' ' 96' ' ' THR . . . -156.81 161.73 39.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.55 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 25.4 t80 -45.42 156.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.073 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -78.19 64.56 3.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.082 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -109.15 -15.45 14.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -90.62 175.74 6.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.787 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -138.68 117.75 12.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.074 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.624 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.8 mp -86.49 -143.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.422 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.602 ' HA3' HG21 ' A' ' 62' ' ' THR . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.635 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.436 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.624 HG12 ' CG2' ' A' ' 44' ' ' VAL . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.731 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.84 95.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 44.6 p -131.86 134.01 45.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.36 152.01 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.34 107.79 6.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.518 ' N ' ' HD2' ' A' ' 136' ' ' PRO . 73.2 Cg_exo -48.23 -48.05 17.93 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.691 2.261 . . . . 0.0 113.204 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 135' ' ' PRO . 56.7 Cg_endo -69.98 89.51 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.037 1.824 . . . . 0.0 112.362 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -139.17 -36.2 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -90.2 143.7 26.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.903 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -68.52 119.05 12.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -66.58 133.34 32.56 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.421 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.7 p -138.09 -55.64 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.791 0.329 . . . . 0.0 110.946 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.67 -68.51 0.56 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.184 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.839 180.0 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.826 0.346 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.56 -163.04 22.71 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.468 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -117.57 -50.72 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.838 0.351 . . . . 0.0 110.924 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.5 t -113.19 -52.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 98.9 m -135.72 -102.91 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.16 70.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.789 0.328 . . . . 0.0 110.79 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -94.98 8.72 41.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.814 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.814 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.543 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 17.4 t30 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 18' ' ' LYS . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.422 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.678 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.92 161.57 18.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.37 117.36 0.53 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.566 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.509 ' HA ' ' HA2' ' A' ' 123' ' ' GLY . 71.5 p -88.39 115.67 26.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.827 0.346 . . . . 0.0 110.953 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.572 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -168.91 -137.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.784 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.484 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 5.0 mt-30 -123.16 175.54 6.59 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.892 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.892 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.898 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.734 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.762 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.408 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.52 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.483 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.664 ' HB2' HG22 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.649 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.8 pp0? -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.762 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.661 HG21 ' O ' ' A' ' 111' ' ' GLY . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.481 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 -66.13 -29.92 70.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.546 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -58.35 125.32 22.8 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.144 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.4 p -110.96 97.61 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.1 m80 60.5 12.34 3.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.038 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.546 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 1.0 OUTLIER -154.05 119.6 5.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.771 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.646 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -58.69 178.16 1.75 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.92 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.494 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.648 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.898 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.734 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.738 HD12 HG23 ' A' ' 105' ' ' VAL . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.11 153.5 23.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.36 -81.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.285 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.47 ' HB3' HD23 ' A' ' 73' ' ' LEU . 54.2 m-20 -125.05 -76.27 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.967 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.535 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -150.33 -47.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.939 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.34 7.24 42.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.827 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.06 -143.8 3.82 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.525 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -127.5 151.05 49.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.957 0.408 . . . . 0.0 110.869 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.594 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.24 131.75 43.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.575 ' HE1' HG22 ' A' ' 85' ' ' VAL . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.798 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.427 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.553 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 0.1 OUTLIER -105.38 -36.78 7.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.417 ' C ' ' O ' ' A' ' 89' ' ' ASN . 23.9 m0 27.44 95.26 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 178.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.39 129.9 61.47 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.003 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.88 -12.87 14.59 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.614 2.209 . . . . 0.0 112.402 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.91 6.42 74.76 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.517 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.39 91.61 3.06 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.656 0.265 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.1 106.64 2.2 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.55 2.166 . . . . 0.0 112.321 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 p 53.0 -163.05 0.09 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.121 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.21 111.68 2.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.0 -166.54 0.13 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.035 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -80.27 -40.58 26.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -116.14 176.74 4.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 73' ' ' LEU . . . 136.52 -144.99 16.84 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.444 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.498 ' H ' ' N ' ' A' ' 117' ' ' PHE . 3.5 tt0 62.98 120.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 111.424 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.443 ' O ' ' HA ' ' A' ' 69' ' ' ARG . 0.9 OUTLIER -175.18 -36.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p -141.28 143.99 34.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.738 HG23 HD12 ' A' ' 68' ' ' LEU . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.941 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.581 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER -121.22 143.47 49.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.13 -174.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.74 -100.17 2.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.8 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.2 m -100.75 -15.72 17.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.725 0.298 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.661 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.81 19.22 1.84 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.245 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -112.27 -157.15 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.645 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.19 162.04 40.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.498 ' N ' ' H ' ' A' ' 102' ' ' GLU . 34.3 t80 -37.68 -78.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 173.07 32.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.01 -20.7 48.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.796 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.31 126.69 31.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.823 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 103.56 15.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.973 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.941 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp -85.3 -163.95 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.509 ' HA2' ' HA ' ' A' ' 26' ' ' THR . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.641 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.11 98.88 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.8 p -131.68 129.36 40.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.989 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.24 97.16 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.814 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.1 p -135.24 149.48 70.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.817 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.49 138.62 46.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.575 2.184 . . . . 0.0 112.331 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.03 97.77 0.95 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.585 2.19 . . . . 0.0 112.357 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 55.88 83.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.167 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.4 t -101.97 129.15 48.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.14 133.47 48.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.21 112.48 4.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.455 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 57.27 23.82 9.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 0.0 111.043 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.07 81.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.912 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.778 0.323 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.8 -27.57 45.83 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.494 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -90.25 130.41 36.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.762 0.315 . . . . 0.0 110.947 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 131' ' ' ALA . 30.8 m -108.05 -160.81 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.126 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.33 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.931 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -126.15 53.84 1.59 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.865 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 6.4 t -90.23 6.91 40.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.813 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.813 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 18.0 t30 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.416 ' H ' ' H ' ' A' ' 18' ' ' LYS . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.709 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.668 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt -139.1 153.06 47.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.545 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 81.29 97.55 0.41 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.684 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.28 -157.81 0.74 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 110.829 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.85 -91.34 0.52 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.291 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -123.51 -170.91 2.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.189 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.873 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.736 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.742 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.727 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.63 ' O ' ' HB ' ' A' ' 56' ' ' THR . 2.0 pp0? -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.475 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.742 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.478 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 -65.48 -30.29 71.05 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.04 102.63 0.3 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.082 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -99.14 -29.75 12.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -76.75 -62.16 1.73 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -151.37 -63.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.947 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.642 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -165.67 179.58 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.556 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.459 ' OG ' HD13 ' A' ' 55' ' ' LEU . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.62 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.88 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.736 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.962 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.475 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -84.56 154.15 22.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.461 ' N ' ' ND2' ' A' ' 70' ' ' ASN . 0.4 OUTLIER -69.52 85.15 0.43 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.04 -179.62 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' ' 73' ' ' LEU . 0.7 OUTLIER 58.71 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.98 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.456 ' H ' ' HB3' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -158.85 31.19 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.765 -179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HD3' ' HB3' ' A' ' 71' ' ' LEU . 1.6 mtpp -75.93 -18.31 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.031 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 100.51 15.38 29.84 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.744 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -126.79 124.44 39.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.834 0.35 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.792 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -93.49 145.49 24.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.547 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.533 HG22 ' CD1' ' A' ' 79' ' ' TRP . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.471 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.642 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 0.8 OUTLIER -132.99 -19.15 2.28 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.535 ' C ' ' O ' ' A' ' 89' ' ' ASN . 29.7 m0 5.3 101.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.821 0.7 . . . . 0.0 112.52 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.53 135.5 62.82 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.182 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.1 -31.91 11.53 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.482 2.122 . . . . 0.0 112.332 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -127.48 86.7 0.33 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.478 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -156.43 97.47 2.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.87 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.19 107.83 1.63 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.565 2.177 . . . . 0.0 112.345 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -75.6 138.66 41.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.924 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 55.9 m -91.04 156.01 18.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -111.39 130.74 55.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . 0.43 ' HB2' ' OD2' ' A' ' 119' ' ' ASP . 0.4 OUTLIER -159.17 -49.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.58 176.49 6.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.883 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -114.6 42.27 1.97 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.548 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -79.67 -161.15 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.845 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.46 97.39 0.58 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.005 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -156.45 150.74 25.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.962 HG21 HD13 ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.763 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.74 ' HE2' ' N ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -122.65 136.12 54.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.74 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.5 OUTLIER 178.08 174.26 0.57 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.722 -179.806 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 95.76 -93.63 1.59 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.799 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 66.3 m -104.01 -19.78 14.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.754 0.311 . . . . 0.0 111.17 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.548 ' HA2' ' HE1' ' A' ' 107' ' ' MET . . . 129.99 20.44 1.32 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.469 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.606 ' HD3' ' HB2' ' A' ' 110' ' ' SER . 0.0 OUTLIER -117.13 -159.61 0.74 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.642 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 105' ' ' VAL . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.442 ' O ' ' C ' ' A' ' 117' ' ' PHE . . . -156.57 162.15 39.92 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.442 ' C ' ' O ' ' A' ' 116' ' ' ALA . 14.0 m-85 -33.45 -76.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.885 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.691 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.0 OUTLIER 166.86 40.89 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.627 178.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.43 ' OD2' ' HB2' ' A' ' 99' ' ' SER . 2.3 m-20 -72.14 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.489 ' HB3' ' SD ' ' A' ' 106' ' ' MET . 4.8 tpt180 -57.99 149.28 23.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -119.63 127.95 53.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.981 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.763 HD21 ' HB2' ' A' ' 106' ' ' MET . 4.5 mp -90.47 -156.61 0.44 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.595 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . . . -66.57 81.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.1 p -132.0 22.38 4.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.998 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.541 ' HA ' ' HB ' ' A' ' 7' ' ' THR . 62.9 m 59.52 -174.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.021 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 89.97 5.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.34 113.47 3.48 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.519 2.146 . . . . 0.0 112.312 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.15 106.97 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.624 2.216 . . . . 0.0 112.268 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -68.41 97.02 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.07 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.6 p -81.51 168.85 17.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 55.15 61.89 2.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.017 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.68 113.48 4.83 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.438 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 80.4 p -72.18 144.78 48.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.79 0.329 . . . . 0.0 110.849 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.69 83.18 6.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.835 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.73 0.3 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.88 -153.06 24.98 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -80.92 155.21 26.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' H ' ' A' ' 4' ' ' VAL . 6.4 m -73.15 -174.64 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.7 m 55.38 76.64 0.26 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.878 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.58 43.24 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.105 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t -90.47 1.8 56.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.876 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.725 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.627 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.496 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.725 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm -130.89 162.76 28.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.0 -126.8 9.01 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.596 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.839 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 56.81 -165.51 0.14 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.821 0.343 . . . . 0.0 111.233 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -124.48 -82.58 0.64 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.43 ' HG2' ' HG2' ' A' ' 120' ' ' ARG . 31.6 mt-30 -119.01 -165.8 1.18 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.974 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.574 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.498 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.839 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.846 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.568 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.673 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.846 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.628 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.917 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.596 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.675 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.537 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.474 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.917 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.675 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 -64.5 -32.06 73.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.491 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -73.23 98.22 2.59 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.887 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 m -61.81 -83.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.999 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -112.6 6.57 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.805 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.491 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 20.6 p -132.01 110.61 10.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.83 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.67 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -55.29 172.32 1.27 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.824 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.493 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.717 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.859 HG22 HD11 ' A' ' 46' ' ' ILE . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.634 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.771 HD21 HG22 ' A' ' 85' ' ' VAL . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.574 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -85.18 161.99 19.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 10.4 mt -84.01 88.26 7.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.274 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.7 OUTLIER 67.82 -81.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.889 -179.538 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.31 39.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.671 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -84.91 -18.35 34.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.239 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 104.59 4.75 42.9 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.844 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.28 125.1 53.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 68' ' ' LEU . 3.2 m-85 -99.58 151.29 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.662 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.771 HG22 HD21 ' A' ' 68' ' ' LEU . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.64 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.755 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 -146.84 -11.07 0.45 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.479 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -34.1 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.779 0.323 . . . . 0.0 111.115 -179.771 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 64.13 146.01 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.325 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.96 -23.48 34.47 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.589 2.193 . . . . 0.0 112.278 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 159.58 18.48 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.53 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.99 87.57 23.03 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.697 0.284 . . . . 0.0 110.857 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 118.62 5.79 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.468 2.112 . . . . 0.0 112.341 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.3 141.76 57.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.0 t -65.4 -45.26 84.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.901 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -97.19 133.07 42.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.4 m -109.26 131.34 55.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.851 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -86.61 3.09 45.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.859 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLY . . . . . 0.724 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 128.96 -173.05 19.49 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.621 ' HB2' ' HE1' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -162.57 121.33 2.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.723 0.297 . . . . 0.0 110.854 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.525 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 7.9 t70 -167.51 -25.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.217 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -153.88 147.97 25.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 -179.99 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.638 HG21 HD13 ' A' ' 68' ' ' LEU . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.789 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER -121.9 145.51 48.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.444 ' HB3' ' H ' ' A' ' 109' ' ' GLY . 0.0 OUTLIER -155.46 -98.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.542 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 108' ' ' ARG . . . -86.05 174.93 48.0 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.919 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.483 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 15.3 m 59.89 10.72 2.24 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.739 0.305 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 53.98 42.2 70.07 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.555 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.505 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -148.88 -156.24 0.7 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.755 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.479 HD21 ' HA ' ' A' ' 114' ' ' ASN . 0.5 OUTLIER -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -154.44 162.14 41.32 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.724 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 34.5 t80 -47.84 -90.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.121 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 170.63 50.62 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.827 0.346 . . . . 0.0 110.528 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.76 21.06 0.42 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.508 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER 55.6 97.66 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.853 0.358 . . . . 0.0 111.103 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -130.26 -9.32 4.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.365 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 106' ' ' MET . 2.0 mp -97.86 -172.92 2.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.48 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.588 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.418 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -46.43 157.63 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.1 m -94.36 91.64 6.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.77 -174.09 3.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -130.74 96.6 22.86 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.847 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' PRO . . . . . 0.41 ' HA ' ' HD2' ' A' ' 136' ' ' PRO . 50.4 Cg_exo -53.76 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 136' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 135' ' ' PRO . 53.2 Cg_endo -69.29 97.26 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.593 2.195 . . . . 0.0 112.268 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 -165.99 0.14 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.256 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -153.44 -16.45 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.58 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.034 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.15 124.48 28.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.52 146.21 54.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 110.965 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.41 -167.49 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.184 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.91 -179.966 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.899 0.381 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.1 -176.64 42.0 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -70.07 149.24 47.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 t -94.18 -77.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 13.6 t 62.61 163.45 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.177 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 71.43 64.57 0.15 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.033 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.464 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t -71.57 2.43 5.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.371 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.574 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.3 t30 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.666 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -129.37 161.26 30.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.01 -123.83 8.01 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.781 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.761 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 58.33 -165.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.806 0.336 . . . . 0.0 111.158 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.25 -71.86 0.51 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.296 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.417 ' H ' ' HB2' ' A' ' 31' ' ' HIS . 17.7 mt-30 -125.79 -172.87 2.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.761 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.894 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.888 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.743 ' H ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.861 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.438 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.531 ' CB ' HG22 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.617 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.617 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.861 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.59 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 -66.28 -31.42 72.21 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -85.45 89.58 7.73 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.953 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.04 -82.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -112.83 16.71 19.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.728 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.554 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 17.7 p -137.62 100.71 4.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -52.15 172.77 0.29 Allowed Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.986 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.61 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.888 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.743 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.902 HD21 ' CE1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.566 ' N ' HD13 ' A' ' 68' ' ' LEU . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER -89.87 157.82 17.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.43 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -62.21 -94.95 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.409 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.43 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -88.32 -78.48 0.33 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.165 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -154.25 -83.75 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HG2' HD12 ' A' ' 73' ' ' LEU . 24.9 pttt -76.43 7.54 4.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.221 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.8 -126.85 0.13 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.594 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -127.7 145.64 50.83 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.902 ' CE1' HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -87.44 151.82 22.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.571 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.762 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.571 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.901 HG22 ' CD1' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.603 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 -136.79 -33.81 0.77 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.412 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 25.64 45.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 178.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.778 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . 58.9 169.5 0.07 OUTLIER Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 120.487 0.184 . . . . 0.0 111.14 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.958 ' HD3' ' HG2' ' A' ' 112' ' ' ARG . 31.3 Cg_endo -63.26 -30.19 73.77 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.247 1.964 . . . . 0.0 112.316 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 134.54 33.78 0.29 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.68 81.37 18.42 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.679 0.276 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -56.96 115.71 2.69 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.626 2.217 . . . . 0.0 112.27 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -70.38 148.02 48.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.7 m -63.33 -46.13 88.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.17 83.69 7.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.93 165.07 28.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.061 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -150.53 -163.66 1.83 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.635 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -57.33 154.67 19.79 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.307 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 7.2 mt-10 -90.07 166.35 13.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.903 0.383 . . . . 0.0 111.403 -179.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.553 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 4.8 t0 -172.6 -28.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.502 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m -154.08 148.59 26.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.798 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.707 HG23 HD12 ' A' ' 68' ' ' LEU . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.587 ' HB2' HD11 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.517 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.63 129.8 51.22 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -166.15 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 64.77 -105.9 1.32 Allowed Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.738 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.406 ' HB2' ' CG ' ' A' ' 112' ' ' ARG . 5.7 m -83.84 35.57 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.57 0.224 . . . . 0.0 111.199 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.594 ' O ' HG21 ' A' ' 56' ' ' THR . . . 55.12 36.03 60.77 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.157 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.958 ' HG2' ' HD3' ' A' ' 92' ' ' PRO . 1.4 ppt_? -132.64 -149.94 0.4 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.645 ' CE3' HG11 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.401 HD21 ' HA ' ' A' ' 114' ' ' ASN . 0.5 OUTLIER -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.74 161.87 39.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -40.69 149.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.048 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.2 OUTLIER -73.58 68.11 1.15 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.972 0.415 . . . . 0.0 111.075 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.99 -2.55 3.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.55 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 120' ' ' ARG . 9.2 mmt180 -68.72 143.54 54.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.697 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.0 92.81 4.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.2 mp -85.04 -146.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.274 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.489 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.62 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ARG . . . . . 0.425 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.54 140.12 2.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.0 m -97.7 128.49 44.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -149.08 6.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.89 139.94 14.59 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.82 114.5 3.89 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.636 2.224 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.57 103.54 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.511 2.141 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -119.28 -61.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.038 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.2 m -83.53 169.86 15.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.853 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 119.05 20.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.18 -156.58 7.24 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.45 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 68.4 m 59.49 -89.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.27 107.73 2.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.954 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 119.14 115.67 2.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.487 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -112.73 -9.03 13.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.439 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 4.4 t -112.0 -21.3 5.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 8.6 m -60.77 98.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -169.37 41.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -87.96 6.65 34.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.799 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.791 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.791 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.601 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.0 t30 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.653 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp -126.02 151.12 47.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.539 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 151.88 121.53 0.94 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.425 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' HH12 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -62.96 127.49 31.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 111.082 -179.785 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -172.64 -149.24 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.811 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -127.18 174.35 8.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.923 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.414 ' CG ' ' HG2' ' A' ' 27' ' ' LYS . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.956 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.546 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.956 HD13 ' HA ' ' A' ' 33' ' ' ARG . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.936 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.746 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.772 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.454 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.506 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.681 ' HB2' ' HE1' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.612 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.772 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.72 HG21 ' O ' ' A' ' 111' ' ' GLY . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 -66.89 -29.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -61.23 96.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.241 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 m -84.84 93.03 8.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.742 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.01 15.86 5.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 -179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.452 ' HB ' ' C ' ' A' ' 123' ' ' GLY . 4.2 p -149.45 106.09 3.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.687 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.661 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -53.22 168.71 1.01 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.942 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.48 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.732 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.936 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.746 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.474 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -89.76 155.3 19.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.419 ' N ' ' ND2' ' A' ' 70' ' ' ASN . 1.2 mt -74.19 80.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.799 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.28 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.895 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.97 34.97 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.74 179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -18.22 59.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.56 9.49 57.64 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.805 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.56 124.97 39.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.719 0.259 . . . . 0.0 110.378 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.719 ' CZ ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -93.87 150.01 20.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 -179.567 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.639 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.678 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.57 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.719 HG13 ' CZ ' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.618 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 -142.48 -31.5 0.52 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.474 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 18.56 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 113' ' ' TRP . . . -43.11 110.84 0.95 Allowed Pre-proline 0 N--CA 1.464 0.242 0 CA-C-O 120.681 0.277 . . . . 0.0 111.489 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.75 128.17 23.68 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.656 2.237 . . . . 0.0 112.261 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 92.91 12.14 58.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.477 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -114.13 88.83 15.6 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.627 0.251 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.63 116.89 4.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.557 2.171 . . . . 0.0 112.292 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.5 p -74.28 131.24 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.67 -179.27 6.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -107.04 121.79 45.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.76 -169.22 2.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.837 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -126.69 128.18 46.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.39 -143.11 5.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . 0.593 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.3 OUTLIER -83.74 -153.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.742 0.306 . . . . 0.0 110.906 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -167.19 98.13 0.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.8 -179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -157.13 158.3 36.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 -179.723 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.441 HG11 ' CE3' ' A' ' 113' ' ' TRP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.804 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.537 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.4 OUTLIER -121.04 142.65 49.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.449 ' HA ' ' HE1' ' A' ' 107' ' ' MET . 18.3 ptt85 173.15 -178.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.044 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.58 -120.61 5.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.83 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.514 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 66.8 m -66.82 -30.73 70.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 111.245 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.72 ' O ' HG21 ' A' ' 56' ' ' THR . . . 131.64 31.61 0.5 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.798 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.514 ' NE ' ' HB2' ' A' ' 110' ' ' SER . 1.1 ptp180 -126.73 -149.91 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.681 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.57 162.18 39.92 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 116' ' ' ALA . 48.8 m-85 -33.36 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.472 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.2 OUTLIER 162.44 -88.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 122.554 0.342 . . . . 0.0 110.661 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 54.39 37.09 26.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.652 HH12 ' HB ' ' A' ' 26' ' ' THR . 0.0 OUTLIER 60.6 122.06 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.946 0.403 . . . . 0.0 111.306 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.64 -32.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.631 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.804 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.6 mp -85.36 -172.05 3.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLY . . . . . 0.452 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.486 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.609 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.36 152.68 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 m -94.59 98.22 10.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' CYS . . . . . 0.439 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.5 OUTLIER -121.82 97.49 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.417 ' OG1' HG11 ' A' ' 4' ' ' VAL . 3.9 m -74.91 115.82 48.05 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.811 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.72 137.55 35.84 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.485 2.124 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.49 3.94 4.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.622 2.214 . . . . 0.0 112.404 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.39 -166.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.218 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -67.56 164.78 18.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.6 -49.85 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.79 120.39 8.81 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 p -140.66 -59.64 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.32 72.36 1.61 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.009 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.808 0.337 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.09 118.34 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.552 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 59.71 -89.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.718 0.294 . . . . 0.0 111.181 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.593 HG12 HG22 ' A' ' 132' ' ' THR . 14.6 m -60.21 153.88 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.235 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 6' ' ' ASN . 5.4 p -124.05 -8.77 7.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 5' ' ' CYS . 1.9 m-80 73.4 66.83 0.1 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.07 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.514 HG22 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t -77.8 13.41 1.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.346 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.805 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.542 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' TRP . . . . . 0.805 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.625 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 16.4 t30 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.402 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.696 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm -114.55 160.6 19.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.473 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -175.68 -161.77 25.61 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.659 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.22 81.82 0.13 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.962 0.411 . . . . 0.0 110.801 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 22.7 mmtm -153.57 -139.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.507 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 47.5 mt-30 -119.61 -177.62 3.42 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.603 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.939 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.739 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.739 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.939 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.954 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.721 ' H ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.528 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.514 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.719 ' HB2' HG22 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.655 ' O ' ' HB ' ' A' ' 56' ' ' THR . 1.7 pp0? -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.718 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.655 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 -66.78 -30.92 71.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.13 109.74 7.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.013 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.36 -28.92 18.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.024 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -69.22 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.916 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.06 -55.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.542 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -163.87 -170.7 29.15 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.577 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.602 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.954 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.778 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.583 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASN . . . . . 0.712 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 4.8 t-20 -89.65 158.72 17.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.23 -8.67 18.17 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.77 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -152.7 26.92 0.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.573 0.225 . . . . 0.0 111.301 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 100' ' ' GLN . 2.7 mp 59.28 -87.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.41 -2.28 55.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.724 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.54 -108.84 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.502 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.9 124.78 38.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 0.0 110.592 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.903 ' CD1' HG22 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -86.83 151.71 23.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 -179.414 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.429 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.538 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.903 HG22 ' CD1' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.412 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASN . . . . . 0.684 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 2.9 m120 -132.06 -33.83 1.31 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.463 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.2 m0 21.3 99.08 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 113' ' ' TRP . . . -41.08 142.04 0.92 Allowed Pre-proline 0 N--CA 1.462 0.16 0 CA-C-O 120.7 0.286 . . . . 0.0 111.488 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.1 -7.45 21.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.518 2.146 . . . . 0.0 112.252 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -72.96 -108.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.435 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -145.0 85.93 7.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.769 0.318 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.52 -3.18 12.96 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.596 2.197 . . . . 0.0 112.311 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 135.58 53.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 t -146.27 163.76 34.48 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.18 95.6 5.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.925 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 m -161.59 -178.64 6.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.887 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLN . . . . . 0.402 ' HA ' HD11 ' A' ' 73' ' ' LEU . 3.1 tt0 -152.76 135.25 15.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 138.21 -144.37 15.56 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.46 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -88.24 99.88 12.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.712 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 6.8 t70 -73.95 163.42 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.43 153.02 36.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.785 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.721 HG23 HD12 ' A' ' 68' ' ' LEU . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' MET . . . . . 0.459 ' CB ' HD11 ' A' ' 122' ' ' LEU . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' MET . . . . . 0.577 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.1 130.41 53.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.405 ' O ' ' HD2' ' A' ' 112' ' ' ARG . 0.0 OUTLIER 176.75 -166.8 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.798 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.496 ' HA3' ' CZ ' ' A' ' 112' ' ' ARG . . . 83.98 -54.81 4.98 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.744 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 52.0 m -154.69 -11.55 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.632 0.253 . . . . 0.0 111.237 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . 0.622 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.38 14.87 2.57 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.169 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ARG . . . . . 0.496 ' CZ ' ' HA3' ' A' ' 109' ' ' GLY . 0.8 OUTLIER -112.83 -153.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TRP . . . . . 0.684 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.77 161.28 39.79 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -48.86 156.81 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.945 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.26 64.86 4.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.078 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . 0.413 ' OD1' ' HG2' ' A' ' 120' ' ' ARG . 3.1 p30 -97.78 -15.57 20.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.628 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 120' ' ' ARG . 0.6 OUTLIER -99.58 -162.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.647 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 121.95 4.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.602 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.1 mp -85.48 -152.67 0.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.575 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' TRP . . . . . 0.473 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.658 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.418 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' HG22 ' A' ' 7' ' ' THR . . . -60.18 -2.5 0.45 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' THR . . . . . 0.593 HG22 HG12 ' A' ' 4' ' ' VAL . 19.0 p -94.6 127.85 40.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.997 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 3.1 p -85.58 3.55 40.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.7 t -132.52 129.38 21.4 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.01 117.61 5.22 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.587 2.191 . . . . 0.0 112.339 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.55 -4.59 15.32 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.574 2.183 . . . . 0.0 112.348 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.21 -168.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.246 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.67 165.81 24.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.906 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.67 -61.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -142.38 -32.69 0.11 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.7 m 59.34 -90.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.661 0.267 . . . . 0.0 111.077 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -97.75 67.9 2.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.126 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.869 -179.926 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.784 0.326 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.811 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.811 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.42 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.613 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.756 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.756 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA2' ' HD2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.884 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.711 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.785 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.495 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.599 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.667 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.495 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.785 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 C--O 1.229 -0.203 0 N-CA-C 112.759 -0.136 . . . . 0.0 112.759 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.884 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.729 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.892 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.587 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.892 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.456 -0.141 0 CA-C-O 120.993 0.425 . . . . 0.0 110.488 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.443 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.795 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.437 ' N ' HG12 ' A' ' 85' ' ' VAL . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.1 m-20 . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.865 0.364 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.675 HG23 HD12 ' A' ' 68' ' ' LEU . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.638 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.638 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 N--CA 1.457 -0.101 0 CA-C-O 120.512 0.196 . . . . 0.0 110.503 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.627 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HD2' ' HA2' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.695 0.283 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.833 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.833 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.405 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm . . . . . 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.89 ' HB3' HD22 ' A' ' 43' ' ' LEU . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.74 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.548 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.89 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.686 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.89 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.576 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.606 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.89 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.599 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.484 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 . . . . . 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.48 -0.248 . . . . 0.0 112.48 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.56 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.89 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.528 ' N ' HD13 ' A' ' 68' ' ' LEU . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.89 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 121.06 0.457 . . . . 0.0 110.354 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.685 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.04 0.448 . . . . 0.0 110.555 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.64 HG23 HD12 ' A' ' 68' ' ' LEU . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.576 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.456 ' SD ' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.685 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.576 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.506 0.193 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.625 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.548 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.697 0.284 . . . . 0.0 110.921 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.812 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.452 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.719 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.812 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.736 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt . . . . . 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.818 0.342 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.836 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.765 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.765 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.511 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.836 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.838 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.847 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.484 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.637 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.481 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.847 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.499 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.674 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.192 0 CA-C-O 120.812 0.118 . . . . 0.0 112.857 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.66 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.949 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.609 ' N ' HD13 ' A' ' 68' ' ' LEU . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.539 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 34.3 t30 . . . . . 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.949 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.004 0.431 . . . . 0.0 110.351 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.709 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.458 ' N ' HG12 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.9 m-20 . . . . . 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.914 0.388 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.736 HG23 HD12 ' A' ' 68' ' ' LEU . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.682 ' HB2' HD21 ' A' ' 122' ' ' LEU . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.441 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.45 ' HD3' ' O ' ' A' ' 113' ' ' TRP . 2.5 ppt_? . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.411 HD22 HH12 ' A' ' 112' ' ' ARG . 4.1 t-20 -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.5 mp . . . . . 0 CA--C 1.528 0.102 0 CA-C-O 120.47 0.176 . . . . 0.0 110.603 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.435 ' O ' ' HG3' ' A' ' 24' ' ' LYS . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.448 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.609 HG22 ' CD1' ' A' ' 22' ' ' PHE . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.512 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.802 0.334 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.75 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.629 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.497 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.624 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.861 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.861 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.877 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.678 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.794 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.619 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.644 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.794 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.44 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 . . . . . 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.594 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.319 0 N-CA-C 112.463 -0.255 . . . . 0.0 112.463 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.577 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.877 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.678 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.956 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.956 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.471 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 85' ' ' VAL . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.683 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p . . . . . 0 C--O 1.231 0.113 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.724 HG23 HD12 ' A' ' 68' ' ' LEU . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.664 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.451 ' CE ' ' HA ' ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.156 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.709 ' HE1' HD12 ' A' ' 46' ' ' ILE . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 106' ' ' MET . 6.0 mp . . . . . 0 C--O 1.233 0.192 0 CA-C-O 120.464 0.173 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.613 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' OD1' ' A' ' 14' ' ' ASN . . . . . . . . 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.735 0.303 . . . . 0.0 110.842 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.744 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.6 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.438 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt . . . . . 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.885 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.862 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.862 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.885 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.875 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.666 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.895 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.479 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.625 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.479 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.895 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 . . . . . 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.677 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.199 0 N-CA-C 112.587 -0.205 . . . . 0.0 112.587 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.445 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.642 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.875 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.697 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.44 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.895 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.953 0.406 . . . . 0.0 110.687 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.711 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 85' ' ' VAL . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 . . . . . 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m . . . . . 0 CA--C 1.521 -0.171 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.73 HG23 HD12 ' A' ' 68' ' ' LEU . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.725 ' HB2' HD21 ' A' ' 122' ' ' LEU . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.542 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.614 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.4 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.591 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.48 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 120.731 0.3 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.784 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.784 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.598 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 . . . . . 0 CA--C 1.528 0.104 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.514 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.93 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.522 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.524 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.93 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.9 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.703 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.814 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.473 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.501 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.814 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 . . . . . 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.236 0 N-CA-C 112.737 -0.145 . . . . 0.0 112.737 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.522 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.9 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.703 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.836 HD12 HG23 ' A' ' 105' ' ' VAL . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.582 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.561 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.131 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.577 ' HE1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.577 HG22 ' HE1' ' A' ' 79' ' ' TRP . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.545 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.724 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 70.8 m-20 . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.166 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.836 HG23 HD12 ' A' ' 68' ' ' LEU . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.691 ' HB3' HD11 ' A' ' 122' ' ' LEU . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.439 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 16.4 ptt180 . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.724 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.511 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.691 HD11 ' HB3' ' A' ' 106' ' ' MET . 5.5 mp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.587 0.232 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.829 0.347 . . . . 0.0 110.91 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.704 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.736 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.579 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.403 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.85 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.785 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.665 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.521 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.85 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.86 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.706 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.482 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.577 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.661 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.661 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.482 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 . . . . . 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.702 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.247 0 N-CA-C 112.902 -0.079 . . . . 0.0 112.902 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.626 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.86 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.706 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.787 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.265 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.586 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.566 HG22 ' NE1' ' A' ' 79' ' ' TRP . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.438 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.73 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 . . . . . 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 68' ' ' LEU . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.523 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.455 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 6.5 ptp180 . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.73 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.702 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.436 0.16 . . . . 0.0 110.63 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.594 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.407 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.665 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.797 0.332 . . . . 0.0 110.912 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.783 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.783 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.414 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.68 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm . . . . . 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.877 ' HA ' HD13 ' A' ' 43' ' ' LEU . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.877 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.689 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.88 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.51 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.586 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 . . . . . 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . . . . . . 0 N--CA 1.451 -0.322 0 N-CA-C 112.558 -0.217 . . . . 0.0 112.558 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.711 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.604 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 46' ' ' ILE . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.689 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.891 HD13 HG21 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.505 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.57 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 3.0 t30 . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.584 ' NE1' HG22 ' A' ' 85' ' ' VAL . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.732 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' NE1' ' A' ' 79' ' ' TRP . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.592 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 1.2 t-20 . . . . . 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.255 0 CA-C-O 120.982 0.42 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.891 HG21 HD13 ' A' ' 68' ' ' LEU . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.654 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.711 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.592 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.654 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.7 mp . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.64 0.257 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.643 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.432 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.726 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.521 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.726 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.639 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.513 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.633 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.661 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.658 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 11.3 mt-30 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.468 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.584 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.517 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.922 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.712 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.766 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.601 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.613 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.613 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.766 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.572 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 . . . . . 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.331 0 N-CA-C 112.516 -0.233 . . . . 0.0 112.516 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.662 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.922 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.712 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.574 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.484 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 2.1 m120 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.958 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 120.916 0.389 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.455 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.757 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' N ' HG12 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.692 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.894 0.378 . . . . 0.0 110.655 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.701 HG23 HD12 ' A' ' 68' ' ' LEU . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.912 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.567 ' HB2' ' O ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.458 -0.055 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.912 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.9 mp . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.47 0.176 . . . . 0.0 110.579 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.428 ' N ' HD23 ' A' ' 130' ' ' LEU . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.78 0.324 . . . . 0.0 110.93 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.857 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.46 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.857 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.2 t-20 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.651 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.724 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt . . . . . 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.852 0.358 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.858 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.731 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.534 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.866 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.647 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.674 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.654 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.458 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.724 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.654 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 . . . . . 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.527 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.543 -0.223 . . . . 0.0 112.543 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.54 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.665 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.866 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.713 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.974 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.445 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.974 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.456 -0.125 0 CA-C-O 121.005 0.431 . . . . 0.0 110.3 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.424 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.745 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 85' ' ' VAL . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.69 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 87.7 m-20 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p . . . . . 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.775 HG23 HD12 ' A' ' 68' ' ' LEU . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.821 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.54 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.475 ' HD2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.69 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 120.583 0.23 . . . . 0.0 110.734 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.615 HG12 ' CG2' ' A' ' 44' ' ' VAL . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.534 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.744 0.307 . . . . 0.0 110.902 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.504 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.785 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.714 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt . . . . . 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.652 0.263 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.936 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.53 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.905 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.735 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.743 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.542 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.736 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.548 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.743 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.45 -0.375 0 N-CA-C 112.491 -0.244 . . . . 0.0 112.491 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.905 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.735 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.979 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.485 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.767 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.557 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.728 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.599 HG21 ' CD2' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.736 HD21 ' HG2' ' A' ' 52' ' ' GLN . 57.4 m-20 . . . . . 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 23.9 m . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.903 0.382 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.979 HG21 HD13 ' A' ' 68' ' ' LEU . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.504 ' CB ' HD11 ' A' ' 122' ' ' LEU . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.728 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.598 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.5 mp . . . . . 0 C--O 1.232 0.159 0 N-CA-C 110.552 -0.166 . . . . 0.0 110.552 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.49 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.634 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.666 0.27 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.479 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.476 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.514 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.868 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.873 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.687 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.827 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.426 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.512 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' HB2' HG22 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.587 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.822 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.452 -0.241 0 CA-C-O 120.873 0.152 . . . . 0.0 112.974 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.407 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.658 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.873 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.687 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.917 HD11 ' HB2' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.62 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.917 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.135 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.415 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.474 ' HE1' HG22 ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.707 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.415 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.68 ' CG2' HD21 ' A' ' 68' ' ' LEU . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.691 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 62.4 m-20 . . . . . 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.1 m . . . . . 0 CA--C 1.52 -0.186 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.699 HG23 HD12 ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.706 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.511 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 112' ' ' ARG . 3.6 ptp180 . . . . . 0 N--CA 1.456 -0.168 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.691 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 106' ' ' MET . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.706 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.1 mp . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.441 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.608 HG22 ' CD1' ' A' ' 22' ' ' PHE . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.533 ' C ' ' HD3' ' A' ' 9' ' ' PRO . 0.7 OUTLIER . . . . . 0 N--CA 1.458 -0.056 0 CA-C-O 120.616 0.246 . . . . 0.0 111.087 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.594 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.723 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.589 HD11 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.4 t-20 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.723 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp . . . . . 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 . . . . . 0 C--O 1.232 0.176 0 CA-C-O 120.831 0.348 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 65' ' ' TRP . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.56 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.868 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.825 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.654 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.893 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.632 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.465 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.884 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 . . . . . 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.57 -0.212 . . . . 0.0 112.57 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.668 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.893 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.725 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.925 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.588 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.7 t30 . . . . . 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.925 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.028 0.442 . . . . 0.0 110.589 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.671 HG11 ' CB ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' N ' HG12 ' A' ' 85' ' ' VAL . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 83.9 m-20 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.011 0.434 . . . . 0.0 110.275 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.709 HG23 HD12 ' A' ' 68' ' ' LEU . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.813 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.173 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.813 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.451 0.167 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.459 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.606 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.41 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.646 0.26 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.79 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.536 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.465 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.544 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.79 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.612 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.665 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm . . . . . 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.79 0.329 . . . . 0.0 111.044 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.9 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.897 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.897 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.731 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.9 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.83 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.624 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.91 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.544 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.874 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.544 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 . . . . . 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.604 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.701 -0.159 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.493 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.624 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.69 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.799 HD12 HG23 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 13.9 t-20 . . . . . 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.629 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.234 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.555 ' HE1' HG22 ' A' ' 85' ' ' VAL . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.686 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.629 HG21 ' CD2' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.747 HD21 ' HG2' ' A' ' 52' ' ' GLN . 52.2 m-20 . . . . . 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.145 0 CA-C-O 120.927 0.394 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.799 HG23 HD12 ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.493 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 105' ' ' VAL . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.624 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.8 mp . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 110.422 -0.214 . . . . 0.0 110.422 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.409 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.635 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.624 HG12 ' CG2' ' A' ' 44' ' ' VAL . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.731 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.706 0.289 . . . . 0.0 110.997 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.814 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.814 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.543 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 18' ' ' LYS . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.422 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.678 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.892 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.892 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.898 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.734 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.762 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.408 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.52 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.483 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.664 ' HB2' HG22 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.649 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.762 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.649 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.481 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 . . . . . 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.646 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.255 0 N-CA-C 112.92 -0.072 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.494 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.648 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.898 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.734 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.738 HD12 HG23 ' A' ' 105' ' ' VAL . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.594 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.575 ' HE1' HG22 ' A' ' 85' ' ' VAL . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.798 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.427 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.599 HD21 ' HG2' ' A' ' 52' ' ' GLN . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.738 HG23 HD12 ' A' ' 68' ' ' LEU . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.941 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.539 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.456 -0.127 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.645 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.941 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.69 0.281 . . . . 0.0 110.848 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.641 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.684 0.278 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.813 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.813 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.416 ' H ' ' H ' ' A' ' 18' ' ' LYS . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.709 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.668 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt . . . . . 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 . . . . . 0 C--O 1.232 0.152 0 CA-C-O 120.744 0.306 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.873 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.736 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.742 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.727 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.768 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.475 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.742 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.478 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 . . . . . 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.642 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.459 ' OG ' HD13 ' A' ' 55' ' ' LEU . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.62 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.88 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.736 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.962 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.475 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.792 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.194 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.547 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.533 HG22 ' CD1' ' A' ' 79' ' ' TRP . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.471 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.768 HD21 ' HG2' ' A' ' 52' ' ' GLN . 6.3 m-20 . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.962 HG21 HD13 ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.763 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.528 ' HB2' ' O ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.528 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.121 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.642 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 105' ' ' VAL . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.763 HD21 ' HB2' ' A' ' 106' ' ' MET . 4.5 mp . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.633 0.254 . . . . 0.0 110.78 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.595 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . . . . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.71 0.291 . . . . 0.0 110.876 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.725 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.627 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.496 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.725 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm . . . . . 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 120.755 0.312 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.574 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.498 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.846 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.568 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.673 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.846 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.628 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.917 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.596 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.675 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.537 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.474 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.917 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.675 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 . . . . . 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.67 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.186 0 N-CA-C 112.824 -0.111 . . . . 0.0 112.824 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.493 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.717 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.859 HG22 HD11 ' A' ' 46' ' ' ILE . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.634 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.771 HD21 HG22 ' A' ' 85' ' ' VAL . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.574 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 68' ' ' LEU . 3.2 m-85 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.662 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.771 HG22 HD21 ' A' ' 68' ' ' LEU . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.64 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.755 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 . . . . . 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.189 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.638 HG21 HD13 ' A' ' 68' ' ' LEU . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.789 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.505 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.099 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.755 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 106' ' ' MET . 2.0 mp . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.48 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.588 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.418 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.464 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.65 0.262 . . . . 0.0 111.371 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.574 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.666 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 . . . . . 0 CA--C 1.527 0.07 0 CA-C-O 120.79 0.329 . . . . 0.0 111.284 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.894 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.888 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.743 ' H ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.861 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.438 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.531 ' CB ' HG22 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.617 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.617 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.503 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.861 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.59 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . . . . . . 0 N--CA 1.453 -0.17 0 CA-C-O 120.814 0.119 . . . . 0.0 112.986 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.61 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.888 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.743 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.902 HD21 ' CE1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.566 ' N ' HD13 ' A' ' 68' ' ' LEU . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.902 ' CE1' HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.571 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.762 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.571 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.901 HG22 ' CD1' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.603 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 . . . . . 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m . . . . . 0 N--CA 1.461 0.107 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.707 HG23 HD12 ' A' ' 68' ' ' LEU . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.587 ' HB2' HD11 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.451 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 1.4 ppt_? . . . . . 0 N--CA 1.455 -0.205 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.645 ' CE3' HG11 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.533 ' HB2' ' HE2' ' A' ' 106' ' ' MET . 3.7 m-20 -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.2 mp . . . . . 0 C--O 1.231 0.131 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.489 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.62 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . 0.425 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.756 0.312 . . . . 0.0 110.799 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.791 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.791 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.601 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.5 t-20 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.653 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.723 0.297 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.956 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.546 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.956 HD13 ' HA ' ' A' ' 33' ' ' ARG . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.936 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.746 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.772 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.454 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.506 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.681 ' HB2' ' HE1' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.612 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.485 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.772 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.667 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 . . . . . 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.661 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.207 0 N-CA-C 112.942 -0.063 . . . . 0.0 112.942 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.48 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.732 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.936 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.746 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.474 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.719 ' CZ ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.639 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.678 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.57 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.719 HG13 ' CZ ' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.618 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.172 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.441 HG11 ' CE3' ' A' ' 113' ' ' TRP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.804 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.511 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 1.1 ptp180 . . . . . 0 N--CA 1.456 -0.146 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.681 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.804 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.6 mp . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . 0.486 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.609 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.514 HG22 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.581 0.229 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.805 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.462 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.542 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' TRP . . . . . 0.805 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.625 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.402 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.696 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm . . . . . 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.603 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.939 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.739 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.739 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.939 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.954 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.721 ' H ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.528 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.514 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.719 ' HB2' HG22 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.718 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.655 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 . . . . . 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.542 ' C ' HD23 ' A' ' 122' ' ' LEU . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.454 -0.258 . . . . 0.0 112.454 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.577 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.602 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.954 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.778 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.583 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASN . . . . . 0.667 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 4.8 t-20 . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.903 ' CD1' HG22 ' A' ' 85' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.429 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.538 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.903 HG22 ' CD1' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.412 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASN . . . . . 0.696 HD21 ' HG2' ' A' ' 52' ' ' GLN . 52.9 m-20 . . . . . 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.976 0.417 . . . . 0.0 110.785 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.721 HG23 HD12 ' A' ' 68' ' ' LEU . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' MET . . . . . 0.459 ' CB ' HD11 ' A' ' 122' ' ' LEU . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' MET . . . . . 0.577 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ARG . . . . . 0.465 ' HB2' ' H ' ' A' ' 113' ' ' TRP . 0.8 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TRP . . . . . 0.684 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.602 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.1 mp . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.458 0.17 . . . . 0.0 110.575 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.658 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.418 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' HG22 ' A' ' 7' ' ' THR . . . . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.791 0.329 . . . . 0.0 111.186 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.67 54.82 0.27 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.526 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -78.39 147.05 34.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.755 0.312 . . . . 0.0 110.879 -179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.4 m -72.85 -171.99 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.468 . . . . 0.0 111.046 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.634 ' HB2' ' HA ' ' A' ' 133' ' ' CYS . 94.5 m -102.44 -92.56 0.32 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.918 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -177.73 74.03 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.793 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.433 ' HB ' ' O ' ' A' ' 132' ' ' THR . 2.9 t -89.37 3.53 51.91 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.974 -179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.811 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.8 m -116.75 82.63 13.11 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.377 -179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.9 Cg_endo -80.1 -64.29 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.699 2.266 . . . . 0.0 112.732 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 3.4 tt0 -127.99 -81.39 0.59 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.206 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 58' ' ' HIS . 0.0 OUTLIER -50.41 -39.51 47.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.034 -179.786 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.811 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.81 145.31 48.74 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.555 179.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.538 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.28 126.09 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.495 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.597 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.65 152.14 24.15 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.821 0.343 . . . . 0.0 111.344 179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.0 m-85 -130.94 -128.97 0.2 Allowed 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.044 -179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -49.58 -45.63 48.1 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.692 0.282 . . . . 0.0 110.955 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.42 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.63 -1.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.409 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.58 158.35 20.91 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.559 0.695 . . . . 0.0 110.868 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.0 t -124.39 166.22 16.35 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.007 179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.34 133.74 53.36 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.929 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -98.07 109.58 22.31 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 178.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.632 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -100.67 126.77 47.21 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.023 -178.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.22 -177.25 21.59 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.682 -0.77 . . . . 0.0 112.596 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.1 OUTLIER -114.37 160.51 19.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 0.0 110.861 179.934 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.499 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -174.23 -164.83 29.85 Favored Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.59 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.03 87.51 0.37 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.773 0.321 . . . . 0.0 110.799 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.415 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 9.4 mmtt -162.95 -142.4 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.906 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.415 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 0.5 OUTLIER -115.43 -176.95 3.03 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.861 0.362 . . . . 0.0 111.088 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.461 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.4 t90 -65.2 -47.97 75.03 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.118 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.613 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.7 m -55.21 -31.07 25.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.986 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.33 -31.62 65.82 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.725 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.66 52.26 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.72 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.66 -39.83 89.83 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.816 179.546 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.39 -31.94 65.97 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.078 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -41.57 77.38 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.324 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.756 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.7 m -77.23 -26.25 52.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.294 179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.99 -21.79 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.988 179.857 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.31 -39.59 79.78 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.45 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 ptm -178.58 -27.18 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.527 -179.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.756 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 7.1 mt-10 -47.59 -91.22 0.0 OUTLIER 'General case' 0 C--O 1.232 0.172 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.457 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.521 ' HA2' ' HD2' ' A' ' 129' ' ' ARG . . . -150.76 -96.52 0.15 Allowed Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.278 -0.963 . . . . 0.0 113.27 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 32.1 tt0 -154.52 162.35 41.19 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 -178.494 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.96 112.91 10.55 Favored 'General case' 0 N--CA 1.434 -1.272 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.884 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.77 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 113.553 -1.658 . . . . 0.0 114.025 -177.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.711 ' N ' ' H ' ' A' ' 67' ' ' GLY . 2.5 t 65.1 48.67 2.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.795 -178.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.785 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.73 140.6 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.947 -179.188 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -135.41 0.35 2.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.949 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 35.4 m -119.05 123.55 28.83 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.317 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.403 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.6 Cg_exo -46.03 -29.33 6.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.365 2.043 . . . . 0.0 111.631 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.495 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.9 tt0 -73.35 -46.25 50.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.846 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.599 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.6 mt-10 -64.81 -43.04 94.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.675 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.667 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.4 -40.8 93.87 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 179.245 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.667 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.3 t70 -68.04 -34.42 76.45 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.756 -0.657 . . . . 0.0 109.635 178.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.495 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.92 -51.55 69.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.422 -178.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.785 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.24 -34.22 63.59 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.117 0.484 . . . . 0.0 110.038 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.47 -42.26 95.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.369 179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -34.73 64.47 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 178.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.425 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 2.7 t60 -64.42 -32.91 74.72 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.944 178.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.446 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -73.33 100.23 3.12 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.003 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t -60.06 -71.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.985 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 10.5 p-80 -130.32 16.08 5.53 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.854 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.446 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 10.8 p -139.56 114.97 9.86 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.874 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.61 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -56.99 175.22 1.47 Allowed Glycine 0 C--N 1.33 0.209 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.759 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.03 162.17 18.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.608 0.242 . . . . 0.0 110.656 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -104.85 132.16 51.44 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 120.912 0.387 . . . . 0.0 110.362 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.884 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.0 OUTLIER -110.3 166.43 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.71 -179.07 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.729 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.75 56.75 4.24 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.967 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.892 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.8 tm? -123.3 126.4 46.81 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.318 0.58 . . . . 0.0 111.883 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.587 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.96 121.38 15.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.497 178.143 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.501 HD21 ' N ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -86.98 149.93 24.42 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.811 0.339 . . . . 0.0 110.981 -179.816 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.14 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.086 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 46.3 m-20 -110.2 -75.15 0.63 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.805 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.6 HD21 ' HA2' ' A' ' 101' ' ' GLY . 0.1 OUTLIER -152.96 -76.99 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.791 179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.99 7.62 12.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.048 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.84 -130.15 0.13 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.603 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -124.33 143.39 50.6 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.8 0.333 . . . . 0.0 110.755 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.892 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -81.78 124.39 29.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.488 -179.738 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.14 141.25 36.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.737 -179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.443 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 39.7 m0 -74.69 151.21 39.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.799 0.333 . . . . 0.0 110.446 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.795 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.25 -25.58 30.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.458 179.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -77.2 -4.64 45.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.677 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.42 7.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.883 179.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.48 125.45 19.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.712 0.291 . . . . 0.0 111.263 179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.9 p-80 -59.17 148.46 31.47 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.94 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.8 t -56.24 158.48 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.165 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.437 ' N ' HG12 ' A' ' 85' ' ' VAL . 5.7 m-20 -127.13 -34.08 2.36 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.447 -179.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -119.63 -47.45 2.43 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.463 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.44 ' HB3' ' HE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.96 157.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.074 -179.688 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.1 m-20 -139.97 -14.78 1.03 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -35.07 112.19 0.14 Allowed 'General case' 0 C--N 1.341 0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 111.548 -178.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.504 ' HB2' ' HD2' ' A' ' 112' ' ' ARG . . . -28.89 115.3 0.28 Allowed Pre-proline 0 N--CA 1.464 0.272 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.938 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -57.63 -66.3 0.08 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.634 2.223 . . . . 0.0 112.311 -179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -99.79 85.37 0.64 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.493 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -120.82 81.75 34.31 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 120.678 0.275 . . . . 0.0 110.956 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.22 142.61 87.07 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.572 2.182 . . . . 0.0 112.361 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.6 40.86 31.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.959 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.07 25.4 0.17 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.885 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -136.31 -17.5 1.55 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.848 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -106.92 83.97 1.91 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.966 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -166.18 -33.95 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.873 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.6 ' HA2' HD21 ' A' ' 73' ' ' LEU . . . 155.59 164.03 12.76 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.387 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.422 ' HA ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.8 131.92 11.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.729 0.3 . . . . 0.0 110.886 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.435 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 3.3 t70 -169.02 -29.21 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.753 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.07 140.11 36.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.452 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.675 HG23 HD12 ' A' ' 68' ' ' LEU . 54.8 t -103.14 137.04 32.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.262 0.553 . . . . 0.0 111.35 -179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.638 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -118.55 168.25 10.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.129 179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.436 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.12 129.68 51.27 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.46 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 168.86 -160.31 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.659 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.67 -109.76 2.97 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.922 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 4.9 m -81.69 37.17 0.46 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.696 0.284 . . . . 0.0 111.224 -179.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.557 ' O ' HG21 ' A' ' 56' ' ' THR . . . 57.94 30.18 63.02 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.495 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.504 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 1.0 OUTLIER -133.13 -146.14 0.27 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.862 0.363 . . . . 0.0 111.095 -179.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.73 160.84 15.41 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 121.56 0.695 . . . . 0.0 111.563 -179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 27.9 m-80 -142.22 119.94 11.86 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.513 175.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.538 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.6 t70 -90.74 122.42 33.47 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.962 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.422 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -156.25 161.99 40.19 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.509 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -40.9 -77.42 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.688 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.49 32.18 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.759 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -95.5 -10.15 30.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.718 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -61.65 113.82 2.93 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.728 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.18 92.33 8.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.062 -179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.638 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.34 -159.18 0.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.503 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -165.49 27.95 0.19 Allowed Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.184 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.61 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -144.35 131.35 20.44 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.16 0.505 . . . . 0.0 111.761 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.499 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 37.5 m0 -98.44 105.3 17.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.636 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.627 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.9 t -112.56 129.76 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 CA-C-O 121.159 0.504 . . . . 0.0 110.092 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.3 m -137.09 166.69 23.12 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.335 -178.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -126.03 143.76 50.98 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.241 0.543 . . . . 0.0 110.356 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.521 ' HD2' ' HA2' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -157.05 149.99 23.69 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.129 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.471 ' O ' HG23 ' A' ' 132' ' ' THR . 0.1 OUTLIER -66.65 133.04 49.43 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.811 0.339 . . . . 0.0 110.76 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -45.06 124.51 4.59 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.678 -179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.471 HG23 ' O ' ' A' ' 130' ' ' LEU . 21.5 p -131.75 -169.0 2.11 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.968 179.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.634 ' HA ' ' HB2' ' A' ' 5' ' ' CYS . 84.0 m -100.64 -172.34 2.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.868 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.2 p -141.51 97.61 6.68 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.918 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.849 ' HG2' ' HB2' ' A' ' 138' ' ' SER . 47.2 Cg_endo -68.7 154.45 71.31 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.495 2.13 . . . . 0.0 112.253 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 54.9 Cg_endo -69.84 -8.63 24.09 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 122.555 2.17 . . . . 0.0 112.323 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.06 -42.48 11.09 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.114 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.849 ' HB2' ' HG2' ' A' ' 135' ' ' PRO . 0.3 OUTLIER -74.0 -177.58 2.94 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.885 179.971 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.52 123.08 21.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.877 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -134.98 -102.43 0.71 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.499 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 32.0 t -124.17 -65.17 1.07 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.317 . . . . 0.0 110.868 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.25 35.57 26.0 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.238 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.203 -0.903 . . . . 0.0 110.922 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.8 p . . . . . 0 N--CA 1.485 1.316 0 CA-C-O 120.796 0.331 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.23 -150.59 22.24 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.468 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -72.7 151.12 42.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.805 0.336 . . . . 0.0 110.849 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.508 HG23 ' H ' ' A' ' 5' ' ' CYS . 0.2 OUTLIER -126.44 -58.43 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.148 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.508 ' H ' HG23 ' A' ' 4' ' ' VAL . 2.4 m 55.01 47.48 22.03 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -168.21 66.92 0.07 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.895 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -91.1 2.8 56.06 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.898 180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.833 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -118.3 83.54 20.76 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.477 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.6 Cg_endo -76.74 -69.45 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.612 2.208 . . . . 0.0 112.616 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.485 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.6 -76.8 0.59 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.1 -179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 9.3 mtpp -52.68 -43.52 65.61 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.814 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.833 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.3 m95 -71.85 140.96 49.59 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.269 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.544 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.27 126.03 52.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.682 -179.674 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.07 152.29 23.59 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.331 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.405 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.9 m-85 -131.16 -128.9 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.038 -179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.25 -45.01 53.81 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-O 120.737 0.303 . . . . 0.0 111.088 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.453 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.47 -2.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.458 179.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.64 158.25 21.09 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.546 0.688 . . . . 0.0 110.912 179.699 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.9 t -124.48 166.13 16.56 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.985 179.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.701 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.3 133.94 53.34 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.21 -0.45 . . . . 0.0 109.813 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.17 109.73 22.43 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.5 m-30 -100.51 127.07 46.98 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.027 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.49 -174.94 16.14 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.577 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 26.6 tttm -121.27 153.92 37.04 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.853 0.358 . . . . 0.0 110.921 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.439 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 161.41 126.81 0.84 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.839 -0.696 . . . . 0.0 112.528 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 8.2 m -93.63 115.8 28.28 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.769 0.319 . . . . 0.0 110.888 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.518 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -167.18 -143.91 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.818 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -116.04 175.86 5.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.736 0.303 . . . . 0.0 110.867 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.493 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 76.8 t90 -64.18 -47.74 78.64 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.975 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.6 m -55.22 -31.05 25.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.939 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.415 ' CG ' ' HG2' ' A' ' 27' ' ' LYS . 23.4 m80 -72.18 -31.89 66.33 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.693 179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.78 51.15 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.716 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.89 ' HB3' HD22 ' A' ' 43' ' ' LEU . 5.4 ptt180 -60.64 -38.86 86.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.881 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.07 -31.82 66.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.994 179.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.0 -41.07 74.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.245 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.74 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.0 m -75.49 -27.53 58.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.195 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -74.8 -22.71 58.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.988 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -58.41 -39.62 80.21 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.408 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.1 -26.88 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.541 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.74 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.0 mm-40 -46.72 -89.64 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.493 -0.322 . . . . 0.0 111.422 -179.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.548 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.33 -94.32 0.1 Allowed Glycine 0 C--N 1.332 0.325 0 C-N-CA 120.331 -0.937 . . . . 0.0 113.396 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.493 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.3 tt0 -154.09 162.06 41.46 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.89 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -74.4 112.88 11.01 Favored 'General case' 0 N--CA 1.434 -1.253 0 N-CA-C 106.558 -1.645 . . . . 0.0 106.558 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.869 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.9 -72.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 113.585 -1.643 . . . . 0.0 114.162 -177.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.686 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.41 50.8 2.78 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 -178.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.89 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.23 142.6 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.008 -179.06 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -133.17 -1.17 3.27 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.826 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.576 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 62.2 m -119.88 123.49 28.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.351 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 83.7 Cg_exo -45.83 -29.47 5.78 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.306 2.004 . . . . 0.0 111.655 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.476 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.5 tt0 -73.34 -46.41 49.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.933 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.576 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 56.2 mt-10 -64.97 -42.93 94.16 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.671 -179.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.606 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.98 -39.97 90.82 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 179.301 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.606 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.6 t70 -68.73 -34.54 75.78 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.566 178.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.476 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.62 -51.39 70.03 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.21 -179.09 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.89 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.25 -33.72 63.41 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.196 178.934 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.854 HG21 ' HA2' ' A' ' 111' ' ' GLY . 0.6 OUTLIER -60.33 -42.27 95.29 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.447 179.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 4.8 mmpt? -73.66 -35.52 65.25 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 115.479 -0.782 . . . . 0.0 108.974 178.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.484 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.8 t60 -63.95 -33.47 75.79 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.217 179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.878 ' HB3' ' HE1' ' A' ' 107' ' ' MET . . . -85.02 103.42 14.03 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.037 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 58.1 m -80.09 88.07 5.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.024 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 37.0 m80 54.97 30.31 13.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.11 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.59 -41.03 3.29 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.874 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.621 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 85.01 146.93 8.54 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.48 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.11 162.37 18.32 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.557 0.218 . . . . 0.0 110.756 179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.56 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.0 m-90 -105.21 132.28 51.62 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-O 120.875 0.369 . . . . 0.0 110.517 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.869 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -109.77 166.82 4.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.747 -179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.48 56.1 4.11 Favored Glycine 0 N--CA 1.446 -0.664 0 CA-C-N 115.217 -0.901 . . . . 0.0 113.033 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.89 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.7 tm? -123.27 125.32 44.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.339 0.59 . . . . 0.0 112.229 179.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.528 ' N ' HD13 ' A' ' 68' ' ' LEU . 7.9 ttt180 -141.09 121.97 14.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.73 178.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.572 ' HB2' ' HA ' ' A' ' 103' ' ' ASP . 2.9 m120 -64.13 155.54 31.21 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.634 -0.426 . . . . 0.0 110.7 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.11 -22.17 58.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.765 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.404 ' O ' ' HG ' ' A' ' 73' ' ' LEU . 0.4 OUTLIER -156.33 -77.36 0.09 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.822 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.489 HD23 ' HA2' ' A' ' 101' ' ' GLY . 0.7 OUTLIER -149.93 -78.47 0.14 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.858 179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.458 ' H ' ' HG2' ' A' ' 74' ' ' LYS . 6.2 pttp -101.47 7.81 42.32 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.89 -179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.27 -113.25 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.915 -0.659 . . . . 0.0 112.707 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -127.29 137.21 52.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.776 0.322 . . . . 0.0 110.989 -179.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.89 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -74.83 127.32 32.9 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.354 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -121.54 141.47 41.86 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.705 -179.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.426 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.7 m0 -74.52 151.75 39.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.765 0.317 . . . . 0.0 110.648 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.746 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.94 32.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.464 179.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -77.32 -4.61 45.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.619 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.29 41.83 7.27 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.834 179.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.5 m -138.95 123.65 18.58 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.78 0.324 . . . . 0.0 111.302 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 10.4 p-80 -55.62 149.05 14.69 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.935 0.398 . . . . 0.0 111.02 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.613 HG23 ' O ' ' A' ' 77' ' ' PHE . 11.3 t -60.71 159.48 2.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.301 -179.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.452 ' N ' HG12 ' A' ' 85' ' ' VAL . 0.6 OUTLIER -124.18 -64.1 1.15 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.222 -179.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -91.3 -44.33 9.25 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.377 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.499 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.56 162.76 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.21 -179.886 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.685 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 87.0 m-20 -140.45 -20.13 0.85 Allowed 'General case' 0 CA--C 1.53 0.195 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.698 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.96 95.89 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.131 0.491 . . . . 0.0 111.499 -179.241 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.425 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 62.62 149.87 0.1 Allowed Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.395 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -68.15 -17.03 45.38 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.511 2.141 . . . . 0.0 112.292 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 145.96 86.22 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.446 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -160.44 112.11 1.37 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 120.607 0.241 . . . . 0.0 110.893 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -70.0 110.38 2.59 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.525 2.15 . . . . 0.0 112.305 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.79 131.17 42.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.88 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 40.1 p -105.36 14.5 28.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.972 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 13.0 ptt-85 -143.51 41.87 1.48 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.96 -73.83 0.35 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.956 179.93 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.64 45.24 25.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.975 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.489 ' HA2' HD23 ' A' ' 73' ' ' LEU . . . -177.77 -103.7 0.17 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.524 179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.425 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 6.6 mt-10 60.5 96.49 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.864 0.364 . . . . 0.0 111.131 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.572 ' HA ' ' HB2' ' A' ' 70' ' ' ASN . 33.9 t70 -137.61 -23.1 1.09 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.794 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.9 144.62 31.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.555 179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.64 HG23 HD12 ' A' ' 68' ' ' LEU . 40.0 t -104.78 136.92 36.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 121.125 0.488 . . . . 0.0 111.115 -179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.576 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.2 OUTLIER -118.33 167.61 11.39 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.064 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.878 ' HE1' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.75 130.72 52.95 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.386 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.431 HH11 ' HD3' ' A' ' 108' ' ' ARG . 0.4 OUTLIER -109.1 165.85 11.28 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.222 -179.549 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -64.94 -13.85 57.81 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.516 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.9 m -52.95 -31.61 41.38 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.835 0.35 . . . . 0.0 110.781 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.854 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 118.12 21.44 4.13 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.709 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.434 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -163.17 -164.68 0.98 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.059 0.456 . . . . 0.0 111.263 -179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.685 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 24.6 m0 -108.17 162.06 14.41 Favored 'General case' 0 CA--C 1.51 -0.559 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.406 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.8 m-20 -132.32 119.76 21.18 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.757 -1.111 . . . . 0.0 108.033 175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.698 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.2 t70 -83.12 124.18 30.23 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.345 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.78 39.95 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.653 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 103' ' ' ASP . 27.9 t80 -41.31 -78.0 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.696 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.32 32.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.718 179.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -95.24 -10.5 30.18 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.704 179.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.443 HH11 ' HD3' ' A' ' 120' ' ' ARG . 20.4 mmt180 -63.4 112.31 2.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.684 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.11 93.94 9.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.034 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.576 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.23 -162.96 0.77 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.544 179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.17 29.13 0.35 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.284 -0.96 . . . . 0.0 113.191 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.621 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -145.77 130.46 18.0 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.162 0.506 . . . . 0.0 111.862 179.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 36.5 m0 -98.33 104.97 17.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.357 179.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.625 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.8 t -112.65 129.88 67.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 CA-C-O 121.261 0.553 . . . . 0.0 110.324 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.5 m -137.2 166.12 24.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.328 -178.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -126.34 143.53 51.13 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 121.211 0.529 . . . . 0.0 110.583 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.548 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 3.1 ptm180 -157.5 158.06 35.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.531 -0.758 . . . . 0.0 109.883 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.439 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.95 136.13 50.2 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.888 0.375 . . . . 0.0 110.841 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.07 -167.08 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.875 -179.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.14 -164.11 1.13 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.003 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 57.67 37.09 27.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.883 -179.958 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.7 p -87.6 137.39 32.16 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.931 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.65 123.62 10.32 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.53 2.153 . . . . 0.0 112.292 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_exo -55.99 111.37 0.75 Allowed 'Trans proline' 0 C--N 1.345 0.382 0 C-N-CA 122.589 2.193 . . . . 0.0 112.23 -179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.47 -35.11 15.3 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.147 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.8 p -152.65 -60.36 0.15 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.869 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -70.23 115.86 9.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.887 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.18 126.78 8.44 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.445 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -74.35 127.86 34.09 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.873 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -150.29 96.16 2.37 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.131 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.891 179.997 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.5 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.805 0.336 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.91 -97.34 0.24 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.492 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -81.83 154.42 25.91 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.707 0.289 . . . . 0.0 110.963 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.6 m -70.63 161.87 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.108 -179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 55.96 29.84 14.99 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.974 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -171.26 52.99 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.904 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 t -91.89 9.66 31.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.921 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.812 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -120.16 82.81 30.67 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.605 -179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.1 Cg_endo -84.29 -72.8 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.792 2.328 . . . . 0.0 112.65 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.452 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.3 OUTLIER -108.19 -88.57 0.47 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.413 -179.643 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.719 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 14.0 mttt -50.38 -45.09 55.15 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.992 0.425 . . . . 0.0 111.095 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.812 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -69.49 133.63 47.92 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.403 179.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.04 126.04 58.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.451 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -106.7 152.22 24.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.355 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.31 -128.37 0.2 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.975 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -50.83 -44.49 59.26 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.959 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.16 -2.15 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.413 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.55 158.45 20.75 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.534 0.683 . . . . 0.0 110.908 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 13.2 t -124.89 166.11 16.86 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.104 179.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.736 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.28 130.34 52.34 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.91 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.7 t80 -97.86 109.66 22.38 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.719 ' HB2' ' HB3' ' A' ' 11' ' ' LYS . 12.6 m-30 -97.48 122.81 40.96 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.049 -178.34 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -132.89 178.54 18.06 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.696 -0.764 . . . . 0.0 113.251 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.631 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 34.1 tttt -134.07 153.24 51.93 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.825 0.345 . . . . 0.0 110.918 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 109.9 -126.86 8.15 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.832 -0.699 . . . . 0.0 112.823 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.811 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.0 -162.74 0.23 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.704 0.288 . . . . 0.0 111.177 -179.831 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -129.84 -78.21 0.55 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.365 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -121.15 -171.85 2.28 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.276 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -61.37 -49.52 76.59 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.001 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.07 -31.2 25.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.692 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.811 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.9 OUTLIER -72.53 -32.72 66.33 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.561 179.646 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.416 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.85 -49.15 49.32 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.69 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.836 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.8 ppt_? -59.63 -39.35 84.06 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.739 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -72.58 -32.11 65.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.035 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.4 -40.57 73.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.378 -179.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.765 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.4 m -76.88 -26.7 54.5 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.959 0.409 . . . . 0.0 110.278 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 5.4 t70 -75.04 -23.41 58.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.97 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -58.27 -39.63 79.75 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.471 -179.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 4.0 ptp -178.61 -27.1 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.596 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.765 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.1 mm-40 -47.08 -88.69 0.0 OUTLIER 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.435 -179.443 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.512 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -155.28 -96.59 0.13 Allowed Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.181 -1.009 . . . . 0.0 113.468 -179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.511 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -154.37 162.27 41.26 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.836 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.28 112.9 10.9 Favored 'General case' 0 N--CA 1.435 -1.215 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 178.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.838 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.38 -70.31 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 113.664 -1.607 . . . . 0.0 114.096 -177.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.657 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.5 t 64.32 48.5 2.8 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -178.211 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.847 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.33 133.32 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.957 -1.019 . . . . 0.0 112.002 -178.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 12.3 p80 -127.22 0.0 6.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.665 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.484 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.18 121.72 31.03 Favored Pre-proline 0 N--CA 1.453 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.177 179.71 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.412 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 79.8 Cg_exo -45.49 -29.71 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 122.22 1.947 . . . . 0.0 111.663 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.3 tt0 -73.29 -45.66 54.29 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.941 179.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.7 mt-10 -65.19 -43.18 92.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.771 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.637 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.73 -40.19 91.9 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 179.298 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.637 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 9.1 t70 -68.37 -34.48 76.15 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.751 -0.659 . . . . 0.0 109.712 178.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.481 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.75 -51.43 69.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.398 -179.011 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.847 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.11 -34.32 63.89 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.175 179.073 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.69 -41.82 95.92 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.497 179.825 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.02 -34.94 64.32 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.051 178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.499 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -66.06 -32.01 73.22 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.388 -0.824 . . . . 0.0 109.933 178.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.515 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -84.51 96.32 9.1 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.01 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.4 t -60.67 -77.76 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.885 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -118.49 9.33 12.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.841 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.515 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 26.6 p -126.44 101.69 6.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.869 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.674 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -52.69 169.48 0.71 Allowed Glycine 0 C--N 1.331 0.3 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.857 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.416 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.31 161.82 17.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.632 0.253 . . . . 0.0 110.611 179.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.596 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -105.43 132.37 51.69 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.838 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.1 pt -112.22 166.56 6.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.644 -179.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.66 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -78.84 56.11 4.25 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.862 -179.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.949 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.9 tm? -125.28 126.9 45.85 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.329 0.585 . . . . 0.0 112.521 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.609 ' N ' HD13 ' A' ' 68' ' ' LEU . 4.3 ttt-85 -139.73 120.82 14.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.214 177.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.757 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 34.3 t30 -89.31 148.36 23.59 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.795 0.331 . . . . 0.0 111.038 -179.585 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.3 mt -47.06 -82.02 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.459 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -112.62 -78.43 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.077 -179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.506 HD21 ' HD2' ' A' ' 117' ' ' PHE . 0.3 OUTLIER -146.43 -56.39 0.27 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.811 -179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.9 mtmt -101.2 7.46 43.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.871 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.39 -135.39 0.14 Allowed Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.46 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -123.29 133.16 54.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.949 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -72.0 120.52 17.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.351 -179.894 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -114.86 141.22 32.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.815 -179.755 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.414 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 38.7 m0 -74.88 151.77 38.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.521 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.709 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.46 -26.22 33.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.367 179.633 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -77.22 -4.77 46.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.607 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.75 41.29 7.29 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 121.011 -0.614 . . . . 0.0 112.956 179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -138.39 125.8 21.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.818 0.342 . . . . 0.0 111.233 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.7 p80 -59.45 149.12 30.44 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.93 0.395 . . . . 0.0 110.987 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 77' ' ' PHE . 21.8 t -57.13 157.99 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.279 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.458 ' N ' HG12 ' A' ' 85' ' ' VAL . 54.1 m-20 -126.58 -48.91 1.52 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.357 -179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -102.93 -46.44 4.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.478 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.459 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.09 156.81 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.09 -179.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.705 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.9 m-20 -140.54 -13.16 1.0 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -179.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.574 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -40.16 107.91 0.08 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.057 0.456 . . . . 0.0 111.319 -179.178 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.458 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . . . -48.76 113.17 2.8 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.276 -179.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -60.53 -12.34 20.56 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.731 2.287 . . . . 0.0 112.379 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.89 19.45 16.38 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.567 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -149.77 72.15 9.65 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 120.694 0.283 . . . . 0.0 110.953 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.32 110.71 3.12 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.539 2.159 . . . . 0.0 112.422 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -80.45 144.94 32.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.86 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.82 169.68 22.79 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.957 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 58.33 -172.66 0.1 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.056 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 54.1 85.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.064 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -79.11 133.21 36.76 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.877 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 175.01 -134.26 2.7 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.462 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -76.52 -167.87 0.89 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.749 0.309 . . . . 0.0 110.925 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.757 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 0.3 OUTLIER -164.48 112.33 1.09 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.032 0.444 . . . . 0.0 110.989 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.8 m -143.34 152.18 41.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.359 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.736 HG23 HD12 ' A' ' 68' ' ' LEU . 40.4 t -102.6 139.19 24.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-O 121.225 0.536 . . . . 0.0 111.125 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.682 ' HB2' HD21 ' A' ' 122' ' ' LEU . 15.1 ptm -118.53 168.39 10.72 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.298 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.461 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.78 129.52 50.63 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.458 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.64 -162.72 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.6 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 66.38 -111.21 3.97 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.034 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' HG3' ' A' ' 112' ' ' ARG . 3.1 m -80.66 39.13 0.46 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.644 0.259 . . . . 0.0 111.335 -179.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.585 ' O ' HG21 ' A' ' 56' ' ' THR . . . 56.7 30.2 59.14 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.415 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.458 ' NE ' ' HB2' ' A' ' 91' ' ' ALA . 2.5 ppt_? -133.77 -146.93 0.28 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.959 0.409 . . . . 0.0 110.993 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.6 m0 -107.91 160.77 15.5 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.424 0.63 . . . . 0.0 111.028 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.411 HD22 HH12 ' A' ' 112' ' ' ARG . 4.1 t-20 -140.4 119.75 13.02 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.845 -1.07 . . . . 0.0 108.179 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.574 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 36.2 t70 -84.18 125.09 31.86 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.862 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.454 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -144.28 161.96 37.6 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.006 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.506 ' HD2' HD21 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -74.47 28.63 0.08 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.454 -179.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.454 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER 68.69 20.25 8.27 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.601 179.517 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.448 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 0.7 OUTLIER -92.74 -6.43 49.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.94 179.576 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.4 mmt180 -83.26 167.41 17.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.904 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -136.04 118.35 15.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.987 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.5 mp -94.22 -143.18 0.24 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.603 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.449 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -165.0 9.85 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.266 -0.969 . . . . 0.0 113.205 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.631 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -145.77 135.52 23.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 117.092 0.446 . . . . 0.0 111.199 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.448 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.3 p-90 -106.58 118.12 35.84 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.171 0.51 . . . . 0.0 110.376 179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.609 HG22 ' CD1' ' A' ' 22' ' ' PHE . 3.7 t -112.26 135.71 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.598 -179.074 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 3.0 m -136.2 165.23 26.23 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.465 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -126.15 143.55 51.09 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.187 0.517 . . . . 0.0 110.39 179.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.512 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.2 OUTLIER -157.36 158.72 36.47 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.031 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -71.03 132.93 45.86 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.957 0.408 . . . . 0.0 110.794 179.705 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.53 -178.41 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.772 -179.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.6 p -94.47 24.16 4.74 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 1.3 m -98.2 30.07 3.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.867 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 81.8 p -75.19 120.18 80.44 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.893 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.38 115.43 2.44 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 122.528 2.152 . . . . 0.0 112.288 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.08 109.24 0.38 Allowed 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.572 2.181 . . . . 0.0 112.346 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -71.29 117.59 13.02 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.063 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.52 -37.47 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -136.67 -28.77 0.97 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.885 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.11 123.13 12.1 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.451 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.45 125.56 27.35 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.827 0.346 . . . . 0.0 110.892 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -151.65 -40.03 0.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.146 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.878 179.989 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 120.835 0.35 . . . . 0.0 111.185 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 107.08 -97.63 1.21 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.521 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -72.29 151.95 42.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.775 0.321 . . . . 0.0 110.943 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.1 t -72.98 143.42 13.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.172 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 133' ' ' CYS . 48.7 t -164.26 65.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.847 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -172.42 57.87 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.935 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.2 t -88.08 1.87 53.26 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.756 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.75 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.3 m -116.33 83.38 12.95 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.478 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.529 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.1 Cg_endo -74.57 -70.11 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.657 2.238 . . . . 0.0 112.623 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.4 OUTLIER -126.24 -78.42 0.59 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.187 -179.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -50.84 -37.69 44.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.029 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.75 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.0 m95 -72.0 144.11 48.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.12 125.89 40.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.41 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.629 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.84 151.49 26.95 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.964 0.411 . . . . 0.0 111.315 -179.954 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.497 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.1 m-85 -127.06 -127.4 0.23 Allowed 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.997 -179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -50.04 -44.7 51.63 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 116.581 -0.281 . . . . 0.0 110.93 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.88 -0.71 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.722 179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.19 21.23 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.44 0.638 . . . . 0.0 110.503 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.6 t -125.32 166.47 16.48 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.243 179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.664 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.03 134.35 53.45 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.806 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.03 109.62 22.34 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 178.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.624 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -100.97 127.0 47.65 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.994 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -138.71 177.39 20.2 Favored Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.684 -179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.549 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 2.7 mptt -126.46 162.81 24.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.778 0.323 . . . . 0.0 110.953 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' HA3' ' CZ2' ' A' ' 125' ' ' TRP . . . 163.66 -145.46 10.5 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.631 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -168.37 107.71 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.807 0.337 . . . . 0.0 111.097 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.565 ' HD3' ' HB3' ' A' ' 31' ' ' HIS . 0.5 OUTLIER -166.12 -144.08 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.818 179.903 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.433 ' H ' ' HB2' ' A' ' 27' ' ' LYS . 1.6 mt-30 -121.11 -178.18 3.69 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.811 0.338 . . . . 0.0 110.934 -179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.47 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.3 t90 -65.84 -48.66 70.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.033 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.53 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.1 m -55.12 -31.03 25.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.812 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.565 ' HB3' ' HD3' ' A' ' 27' ' ' LYS . 0.9 OUTLIER -72.24 -32.56 66.81 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.682 179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.93 -49.02 50.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.818 179.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.861 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.23 -38.0 82.07 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.832 179.423 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -72.49 -31.15 65.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.956 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.2 -40.52 71.11 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.311 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -75.38 -27.72 59.21 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 0.0 110.229 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -74.95 -23.91 58.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.038 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.36 -39.74 80.36 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.493 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -179.86 -27.04 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.495 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 47.1 mm-40 -46.23 -86.77 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.34 -179.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.96 -94.8 0.1 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.274 -0.965 . . . . 0.0 113.307 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.91 162.24 41.16 Favored 'General case' 0 CA--C 1.509 -0.625 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 -178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.861 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.0 tp -73.97 112.83 10.47 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.877 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.6 -69.62 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 113.64 -1.618 . . . . 0.0 114.014 -177.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.678 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 63.7 48.13 3.42 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.794 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.65 138.46 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 114.953 -1.021 . . . . 0.0 111.999 -178.991 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -134.48 0.7 3.06 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.823 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.619 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -118.09 122.76 30.09 Favored Pre-proline 0 N--CA 1.453 -0.29 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.151 179.689 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -45.45 -29.93 5.3 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.366 2.044 . . . . 0.0 111.605 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.55 -46.2 48.95 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.069 179.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.619 ' HG3' ' HB3' ' A' ' 48' ' ' SER . 69.6 mt-10 -64.75 -43.0 94.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.766 -179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.644 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.81 -40.29 91.72 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.644 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 20.1 t0 -68.31 -34.59 76.4 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.649 178.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.53 69.33 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.507 -178.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.794 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.03 -33.92 63.93 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.13 0.49 . . . . 0.0 109.887 178.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.603 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.39 -39.35 87.0 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.326 179.624 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.4 mtmt -75.19 -34.8 61.57 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.485 -0.78 . . . . 0.0 108.937 178.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.44 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 36.4 t60 -65.37 -31.66 72.9 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.241 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.578 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -88.43 113.8 24.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.067 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -79.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.051 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -140.58 31.36 1.87 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.951 -179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 1.6 p -112.2 -53.68 2.69 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.938 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.594 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 106.06 158.23 22.18 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.463 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.48 162.14 18.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.689 0.28 . . . . 0.0 110.799 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.577 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -104.53 132.58 50.61 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.017 0.437 . . . . 0.0 110.471 179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.877 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.56 166.79 5.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.649 -179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.678 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.03 55.3 3.53 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.32 -0.855 . . . . 0.0 112.963 -179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.956 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.89 127.06 47.45 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.367 0.603 . . . . 0.0 112.108 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.22 120.93 15.31 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.329 177.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.433 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -91.09 156.67 17.73 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.87 0.367 . . . . 0.0 110.828 -179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.5 80.53 0.57 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.706 -179.767 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 63.38 -80.94 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.748 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -163.83 29.68 0.08 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.494 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -76.32 -18.62 58.84 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.327 -179.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 105.59 -4.68 40.08 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.569 -0.824 . . . . 0.0 113.051 179.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -103.01 123.83 47.36 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.892 0.346 . . . . 0.0 110.375 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.956 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -100.0 130.77 46.2 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.105 0.479 . . . . 0.0 110.904 -179.335 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -125.37 141.16 46.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.47 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.471 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.5 m0 -74.6 151.0 39.43 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.942 0.401 . . . . 0.0 110.796 -179.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.726 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.25 -25.62 31.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.486 179.673 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -77.1 -1.92 31.56 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.601 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.42 42.11 8.73 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.828 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.38 122.62 14.79 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.663 0.268 . . . . 0.0 111.252 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.4 p-80 -53.49 150.53 6.61 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.854 0.359 . . . . 0.0 111.152 179.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.542 HG21 ' HB2' ' A' ' 77' ' ' PHE . 6.6 t -57.68 159.81 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.449 -179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.446 ' N ' HG12 ' A' ' 85' ' ' VAL . 42.1 m-20 -125.68 -65.08 1.02 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.178 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -87.41 -46.27 9.78 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.364 -179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.483 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.17 156.44 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.125 -179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.683 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 90.4 m-20 -140.79 -12.58 0.98 Allowed 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.531 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -36.92 109.95 0.11 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 120.986 0.422 . . . . 0.0 111.152 -179.193 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -41.38 128.86 2.23 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.628 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.97 -33.73 1.42 Allowed 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.683 2.255 . . . . 0.0 112.346 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -88.82 31.14 5.09 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.539 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -117.88 81.55 15.75 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -56.57 127.84 27.59 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.571 2.181 . . . . 0.0 112.342 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.7 p -73.94 128.53 35.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.858 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -91.05 6.24 45.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.907 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.2 OUTLIER 56.7 86.76 0.06 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.037 179.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 14.8 m -117.37 -166.51 1.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 119' ' ' ASP . 15.8 mm-40 -86.81 -175.2 5.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.827 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 122.61 -148.83 16.94 Favored Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.579 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.664 ' H ' ' HB2' ' A' ' 118' ' ' CYS . 0.4 OUTLIER -142.26 -88.37 0.15 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.657 0.265 . . . . 0.0 111.044 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -164.18 103.51 0.87 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.922 -179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.8 p -164.35 147.07 9.03 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.277 0.561 . . . . 0.0 111.809 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.724 HG23 HD12 ' A' ' 68' ' ' LEU . 39.7 t -104.92 136.8 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.944 178.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.664 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.3 ptt? -117.69 167.03 11.72 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.447 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.578 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -125.3 129.93 50.99 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.457 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 108' ' ' ARG . 0.0 OUTLIER 171.76 -165.47 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.88 -179.865 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 72.73 -133.34 19.01 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.909 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.479 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 70.4 m -53.91 -24.8 17.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.74 0.305 . . . . 0.0 111.163 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.71 27.33 0.96 Allowed Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.429 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.53 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -129.51 -148.45 0.37 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 0.0 111.101 -179.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.709 ' HE1' HD12 ' A' ' 46' ' ' ILE . 36.8 m0 -107.71 161.77 14.58 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-O 121.344 0.592 . . . . 0.0 111.198 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.487 ' HB3' HH12 ' A' ' 120' ' ' ARG . 3.9 m120 -140.34 119.44 12.78 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 175.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.531 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 26.7 t70 -89.33 124.09 34.11 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.311 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.55 161.7 39.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.383 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.419 ' HB3' ' N ' ' A' ' 102' ' ' GLU . 52.9 m-85 -44.32 -77.26 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.571 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.664 ' HB2' ' H ' ' A' ' 102' ' ' GLU . 0.1 OUTLIER 174.18 32.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.734 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 100' ' ' GLN . 5.5 t70 -113.71 56.55 0.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.922 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.487 HH12 ' HB3' ' A' ' 114' ' ' ASN . 0.8 OUTLIER -126.35 -39.25 2.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.714 179.84 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.402 ' HE3' ' HG3' ' A' ' 28' ' ' GLN . 0.1 OUTLIER 58.87 99.52 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.101 179.894 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.664 HD21 ' HB2' ' A' ' 106' ' ' MET . 6.0 mp -85.28 -153.62 0.17 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.66 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.42 25.2 0.45 Allowed Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.163 -1.018 . . . . 0.0 113.412 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.594 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -151.54 130.82 12.8 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 117.141 0.47 . . . . 0.0 111.709 179.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.53 ' CZ2' ' HA3' ' A' ' 25' ' ' GLY . 1.1 m0 -97.31 109.16 21.97 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.376 179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.613 HG22 ' CD1' ' A' ' 22' ' ' PHE . 5.2 t -112.83 129.94 67.54 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 CA-C-O 121.158 0.504 . . . . 0.0 110.215 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.43 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.9 m -136.3 166.5 23.29 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.39 -178.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.1 p-10 -125.97 143.7 50.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.127 0.489 . . . . 0.0 110.259 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.408 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 6.2 ttt85 -157.24 149.88 23.23 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.056 -179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.82 146.19 54.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.789 0.328 . . . . 0.0 110.784 179.835 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.517 ' HB2' ' OD1' ' A' ' 14' ' ' ASN . . . -51.87 179.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.028 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.05 5.95 50.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.133 -179.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.456 ' HB3' ' HB2' ' A' ' 5' ' ' CYS . 0.8 OUTLIER -130.1 148.53 51.96 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.3 135.13 88.94 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.84 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.06 146.17 51.51 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.605 2.203 . . . . 0.0 112.255 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.44 99.91 0.74 Allowed 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.526 2.15 . . . . 0.0 112.291 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -73.07 113.38 10.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.131 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.9 t -118.4 -17.62 9.38 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.824 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . 0.477 ' HB3' ' H ' ' A' ' 140' ' ' GLY . 5.9 tt0 59.34 -89.79 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.101 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . 0.477 ' H ' ' HB3' ' A' ' 139' ' ' GLU . . . 112.02 -25.78 12.36 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.451 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.76 151.55 39.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 0.0 110.874 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -69.96 94.24 0.84 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.098 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 . . . . . 0 C--O 1.25 1.084 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.061 179.969 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.84 0.353 . . . . 0.0 111.161 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 86.27 112.76 0.84 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.564 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -67.16 147.72 52.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.869 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 14.7 t -99.49 -75.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.113 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 53.3 45.95 27.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.956 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -169.11 84.04 0.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.894 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t -115.06 0.61 13.69 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.842 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.1 m -112.99 85.45 7.94 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.514 -179.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.513 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.4 Cg_endo -74.41 -70.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.575 2.183 . . . . 0.0 112.644 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.477 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.5 OUTLIER -125.92 -77.96 0.59 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.234 -179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.495 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 1.8 mtpp -51.43 -37.83 50.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.052 0.453 . . . . 0.0 110.885 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.744 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 16.9 m95 -71.48 143.83 49.9 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.586 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.45 126.13 44.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.376 179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.6 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.84 152.08 24.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.866 0.365 . . . . 0.0 111.259 -179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.438 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.5 m-85 -130.61 -128.91 0.2 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.082 -179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -49.89 -44.99 50.36 Favored 'General case' 0 C--O 1.231 0.104 0 CA-C-O 120.693 0.282 . . . . 0.0 111.021 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -165.84 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.42 179.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.407 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.4 158.0 21.19 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-O 121.471 0.653 . . . . 0.0 111.018 179.696 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.8 t -124.18 166.23 16.2 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 114.868 -1.06 . . . . 0.0 110.043 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.668 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.94 133.01 53.81 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.109 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.6 t80 -97.87 109.51 22.25 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.9 m-30 -97.78 123.21 41.63 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.861 -178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.53 173.74 21.02 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 120.604 -0.807 . . . . 0.0 113.341 -179.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.614 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.0 ttpt -140.85 153.03 45.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.933 0.397 . . . . 0.0 110.843 179.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 83.72 94.36 0.64 Allowed Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.722 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.8 -156.99 0.69 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.703 0.287 . . . . 0.0 110.805 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.486 ' HB2' ' CG ' ' A' ' 31' ' ' HIS . 7.5 mmtp -112.98 -95.19 0.45 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.247 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -121.13 -167.78 1.56 Allowed 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.838 0.351 . . . . 0.0 111.233 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.447 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 81.4 t90 -61.88 -49.34 76.59 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.039 -179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.512 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.1 m -55.16 -31.37 25.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.808 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.486 ' CG ' ' HB2' ' A' ' 27' ' ' LYS . 0.3 OUTLIER -72.62 -32.07 65.64 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.642 179.655 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.91 -49.03 50.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.782 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.885 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.26 -38.81 84.66 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.385 -0.371 . . . . 0.0 110.648 179.395 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -72.6 -28.19 62.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.879 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -73.37 -40.42 64.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.371 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.862 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 2.7 m -76.0 -27.69 57.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.077 0.465 . . . . 0.0 110.189 179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.15 -24.99 58.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.048 179.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -39.73 80.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.408 -179.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 3.1 ptp 179.98 -27.24 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.443 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.862 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 39.4 mm-40 -47.71 -86.61 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.343 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -157.28 -96.12 0.12 Allowed Glycine 0 C--N 1.331 0.305 0 C-N-CA 120.223 -0.989 . . . . 0.0 113.515 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -155.1 162.22 41.07 Favored 'General case' 0 CA--C 1.509 -0.631 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -178.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.885 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.7 tp -74.4 112.89 11.02 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 106.695 -1.595 . . . . 0.0 106.695 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.875 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.71 -71.21 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 113.616 -1.629 . . . . 0.0 114.282 -177.33 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.666 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER 63.39 50.72 2.81 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 -178.095 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.895 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -41.6 135.72 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.043 -0.981 . . . . 0.0 112.091 -178.867 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -127.69 -1.06 6.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.745 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.609 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 6.5 m -118.39 121.33 31.18 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.056 179.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 85.6 Cg_exo -45.2 -29.27 4.12 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.235 1.957 . . . . 0.0 111.77 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.479 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.4 tt0 -73.25 -46.1 52.04 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.924 179.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.609 ' HG3' ' HB2' ' A' ' 48' ' ' SER . 55.4 mt-10 -65.41 -43.02 91.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.716 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.625 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -66.21 -39.73 89.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.971 0.415 . . . . 0.0 109.922 179.274 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.9 t70 -68.81 -34.44 75.51 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.578 178.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.479 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.6 -51.4 69.98 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.336 -178.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.895 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.16 -34.66 63.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.099 179.151 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.619 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.67 -40.77 93.32 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.512 179.708 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.97 -34.8 62.07 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 5.2 t60 -65.51 -32.16 73.61 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.059 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.482 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -78.83 99.03 6.55 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.023 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.5 m -63.07 -74.54 0.09 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.96 -179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -123.54 13.18 9.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.88 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.433 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 18.3 p -134.06 106.57 7.28 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.924 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.677 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -55.16 168.78 2.12 Favored Glycine 0 N--CA 1.453 -0.199 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.587 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.445 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -111.66 161.15 16.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.616 0.246 . . . . 0.0 110.611 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.642 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -105.02 132.16 51.61 Favored 'General case' 0 CA--C 1.516 -0.345 0 C-N-CA 120.72 -0.392 . . . . 0.0 110.516 179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.875 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.81 166.87 5.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.754 -179.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.697 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.21 55.17 3.6 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 115.263 -0.88 . . . . 0.0 113.192 -179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.895 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -124.36 127.22 47.26 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.286 0.565 . . . . 0.0 112.124 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -139.22 121.66 16.12 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.32 178.109 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 103' ' ' ASP . 0.1 OUTLIER -84.23 154.59 22.94 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.037 0.446 . . . . 0.0 111.086 -179.527 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.18 -71.93 0.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.229 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -136.62 84.02 2.04 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.392 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 102' ' ' GLU . 5.6 mp 56.55 -89.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.666 179.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -82.35 7.43 14.06 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.636 -179.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -164.71 3.28 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.576 -0.821 . . . . 0.0 112.388 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -88.32 132.5 34.38 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.844 0.354 . . . . 0.0 110.203 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.895 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -74.69 120.27 20.01 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.687 -179.298 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.96 141.08 36.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.474 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.457 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 39.3 m0 -74.74 151.66 39.15 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.587 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.711 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.24 -26.14 32.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.463 179.693 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -77.42 -4.82 47.28 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.65 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.89 41.72 7.06 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.9 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.85 123.89 18.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.75 0.309 . . . . 0.0 111.251 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -57.57 149.68 20.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.922 0.391 . . . . 0.0 111.012 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 77' ' ' PHE . 39.9 t -55.85 155.52 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.311 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.426 ' N ' HG12 ' A' ' 85' ' ' VAL . 51.1 m-20 -127.47 -38.48 1.93 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.405 -179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -111.69 -47.28 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.416 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.476 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.04 154.47 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.238 -179.852 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.694 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 89.6 m-20 -140.41 -12.43 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -39.21 105.52 0.04 OUTLIER 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.965 0.412 . . . . 0.0 111.031 -179.345 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.95 124.04 1.6 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.592 -179.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -83.76 -7.93 10.36 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.74 2.293 . . . . 0.0 112.435 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.96 15.59 31.73 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.622 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -137.74 72.43 49.05 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 120.776 0.322 . . . . 0.0 110.984 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_exo -56.7 112.56 1.13 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 122.52 2.147 . . . . 0.0 112.277 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.01 122.76 21.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.4 m -130.49 -56.32 1.08 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.912 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.52 97.12 4.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.896 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 84.4 p -150.86 -171.88 4.05 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.908 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 -68.09 -22.13 64.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.954 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 130.91 -152.03 19.8 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.536 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 3.0 pt-20 -168.68 92.27 0.29 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.782 0.325 . . . . 0.0 110.876 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.549 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 36.8 t70 -116.04 -8.07 11.87 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.21 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 31.9 m -149.26 151.9 35.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.934 0.397 . . . . 0.0 110.081 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.73 HG23 HD12 ' A' ' 68' ' ' LEU . 39.6 t -101.32 137.9 27.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.195 0.521 . . . . 0.0 110.949 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.725 ' HB2' HD21 ' A' ' 122' ' ' LEU . 23.4 ptm -118.3 168.49 10.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.232 -179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.542 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -124.76 129.07 49.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.199 -179.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 166.3 170.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.523 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 110' ' ' SER . . . 65.1 120.89 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.565 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 109' ' ' GLY . 1.1 m 69.19 -71.85 0.11 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.761 0.315 . . . . 0.0 110.983 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 160.02 30.44 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.854 -0.689 . . . . 0.0 112.797 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.582 ' HD2' ' N ' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -137.08 -149.94 0.34 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.909 0.385 . . . . 0.0 111.328 -179.856 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.694 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 30.3 m0 -108.36 162.44 14.09 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.309 0.576 . . . . 0.0 111.184 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.481 ' O ' ' HG2' ' A' ' 106' ' ' MET . 7.8 m120 -139.21 119.29 13.5 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.602 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 32.0 t70 -81.31 115.85 20.88 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.09 -179.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.516 ' C ' ' HA ' ' A' ' 102' ' ' GLU . . . -157.42 161.2 38.95 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.891 0.377 . . . . 0.0 111.246 -179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.536 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 1.5 t80 -50.76 143.64 9.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.681 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.437 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -81.85 71.65 8.88 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.98 -179.914 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -118.89 53.63 0.99 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.164 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.47 ' HG2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.2 93.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.272 179.658 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 15.1 mmtp -131.65 -12.03 3.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.451 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 106' ' ' MET . 3.0 mp -115.26 -162.29 0.82 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.813 0.34 . . . . 0.0 111.298 -179.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.41 15.46 0.22 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.949 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.614 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -138.64 135.83 35.3 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 116.868 0.334 . . . . 0.0 110.915 179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.4 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -107.42 117.2 33.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.199 0.523 . . . . 0.0 110.762 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.591 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.7 t -112.51 137.88 43.71 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.503 -179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.454 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 5.3 m -138.4 165.69 26.14 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.577 -178.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -126.31 144.5 50.78 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.132 0.491 . . . . 0.0 110.462 179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.48 ' HG2' ' H ' ' A' ' 130' ' ' LEU . 0.0 OUTLIER -156.31 168.35 27.6 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.983 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.48 ' H ' ' HG2' ' A' ' 129' ' ' ARG . 0.1 OUTLIER -83.52 140.27 32.39 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.885 0.374 . . . . 0.0 110.93 179.845 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.55 154.46 0.45 Allowed 'General case' 0 C--O 1.232 0.152 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.675 -179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 49.6 m -94.62 90.81 6.28 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.907 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 7.5 t -139.91 18.57 2.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.1 m 56.17 73.91 0.77 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.008 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.526 ' HB2' ' HD3' ' A' ' 136' ' ' PRO . 74.8 Cg_exo -48.73 -47.91 19.43 Favored 'Trans proline' 0 CA--C 1.535 0.54 0 C-N-CA 122.712 2.275 . . . . 0.0 113.299 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.526 ' HD3' ' HB2' ' A' ' 135' ' ' PRO . 40.1 Cg_exo -57.55 104.44 0.16 Allowed 'Trans proline' 0 C--N 1.353 0.786 0 C-N-CA 122.055 1.837 . . . . 0.0 112.285 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -69.04 107.21 3.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.071 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -67.61 172.25 5.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.917 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -63.67 127.68 32.45 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.908 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.3 122.37 15.13 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.514 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.1 p -70.0 134.98 48.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.782 0.325 . . . . 0.0 110.896 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -85.7 -67.9 0.77 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.117 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.001 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.8 p . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.799 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -69.61 132.08 24.48 Favored Glycine 0 N--CA 1.452 -0.252 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.474 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.1 p90 -114.87 10.69 16.48 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.807 0.337 . . . . 0.0 110.963 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.761 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 2.8 t -117.04 -21.1 5.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.022 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.562 ' HB3' ' HB1' ' A' ' 131' ' ' ALA . 1.8 m -61.7 107.76 0.88 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.877 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -152.4 29.71 0.55 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.903 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.1 t -89.84 5.54 45.74 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.913 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.784 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.5 80.18 12.86 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.449 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.546 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.3 Cg_endo -77.6 -67.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.612 2.208 . . . . 0.0 112.842 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 8.7 tt0 -122.91 -83.14 0.66 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.295 -179.707 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.49 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 5.4 mtpt -49.79 -40.11 40.43 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.028 -179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.784 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.4 m95 -72.03 142.6 49.29 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.442 179.689 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.546 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.35 126.02 44.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.686 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.598 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.25 152.19 23.83 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.854 0.359 . . . . 0.0 111.189 179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.423 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.95 -128.98 0.2 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.026 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.99 -44.39 50.97 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.016 -179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.4 OUTLIER -166.41 -2.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.455 179.89 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.62 158.42 20.86 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.467 0.651 . . . . 0.0 110.908 179.695 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.0 t -124.24 165.97 16.68 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.889 -1.051 . . . . 0.0 110.061 179.322 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.708 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.61 133.1 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.022 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.494 ' CE2' ' HG2' ' A' ' 40' ' ' GLU . 2.3 t80 -97.92 109.24 22.04 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 178.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.623 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -99.42 125.8 45.2 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.985 -178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -146.42 -175.66 19.6 Favored Glycine 0 C--N 1.331 0.293 0 C-N-CA 120.654 -0.784 . . . . 0.0 112.974 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 11.4 ttmm -116.3 159.07 22.42 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.763 0.316 . . . . 0.0 110.905 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 156.29 138.05 2.46 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.568 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.4 ' HB ' ' H ' ' A' ' 27' ' ' LYS . 18.7 p -77.2 -129.76 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.488 0.185 . . . . 0.0 110.761 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.4 ' H ' ' HB ' ' A' ' 26' ' ' THR . 15.6 mmtt 66.78 -163.81 0.23 Allowed 'General case' 0 N--CA 1.461 0.104 0 CA-C-O 120.748 0.308 . . . . 0.0 111.065 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.1 mp0 -112.71 -167.9 1.25 Allowed 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.979 0.419 . . . . 0.0 111.519 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.514 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 75.1 t90 -66.27 -47.16 74.58 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.453 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.514 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 10.5 m -54.88 -31.22 24.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.198 -179.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -72.34 -31.26 65.47 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.725 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.83 -48.65 52.91 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.793 0.33 . . . . 0.0 110.766 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.93 ' HB3' HD22 ' A' ' 43' ' ' LEU . 2.9 ptm180 -61.3 -39.98 92.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.967 179.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.415 ' N ' ' HG3' ' A' ' 33' ' ' ARG . 0.9 OUTLIER -72.28 -33.31 67.34 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.084 -179.859 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.67 82.7 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.767 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.9 m -78.49 -24.97 45.6 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -74.88 -21.82 59.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.064 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.3 -39.49 79.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.489 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -177.94 -27.08 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.767 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 1.4 mp0 -46.97 -92.2 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.459 -179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.522 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -149.61 -97.35 0.17 Allowed Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.221 -0.99 . . . . 0.0 113.342 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.524 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -154.33 162.28 41.26 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -178.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.93 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.7 tp -73.78 112.87 10.3 Favored 'General case' 0 N--CA 1.433 -1.303 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 179.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.9 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.62 -70.82 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.437 -1.711 . . . . 0.0 114.116 -177.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.703 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.4 OUTLIER 64.35 53.9 1.63 Allowed 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.266 0.555 . . . . 0.0 109.538 -178.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.814 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -46.46 139.83 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.907 -178.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.402 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 9.7 p-80 -134.47 0.77 3.07 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.747 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.473 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -120.01 123.89 28.14 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.312 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -46.21 -29.87 7.13 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.303 2.002 . . . . 0.0 111.546 179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.501 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.7 tt0 -73.28 -46.23 51.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.996 179.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.567 ' HB2' HG22 ' A' ' 46' ' ' ILE . 62.9 mt-10 -63.61 -43.7 96.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.814 -179.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.63 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.09 -40.62 96.63 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.055 0.455 . . . . 0.0 109.915 179.196 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 10.1 t70 -68.17 -34.82 77.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.745 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.501 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.15 70.81 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.545 -178.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.814 HD21 HD13 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.77 -33.67 64.36 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.065 0.459 . . . . 0.0 109.962 179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.606 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -60.45 -40.67 91.99 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.42 179.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -35.01 64.36 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.174 178.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.49 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 25.0 t-80 -66.93 -31.2 71.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.035 179.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.458 ' HB3' ' HE3' ' A' ' 107' ' ' MET . . . -77.36 98.81 5.35 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.967 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 m -59.06 -80.83 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.959 -179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -119.78 11.2 11.83 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.905 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.457 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 9.5 p -133.57 113.75 12.79 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -56.52 172.31 2.06 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.737 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -114.02 162.04 16.93 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.501 0.191 . . . . 0.0 110.584 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.522 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -105.15 132.07 51.83 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.368 179.455 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.9 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.04 166.83 5.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.391 -179.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.703 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.93 54.2 2.16 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.473 -0.785 . . . . 0.0 113.033 -179.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.836 HD12 HG23 ' A' ' 105' ' ' VAL . 1.9 tm? -123.17 128.34 49.92 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.441 0.639 . . . . 0.0 112.604 -179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.582 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -137.84 121.02 16.83 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.133 177.702 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.05 140.15 29.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.991 0.424 . . . . 0.0 111.177 -179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.89 131.69 44.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.885 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 59.07 -90.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.039 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -166.09 -48.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.881 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' A' ' 74' ' ' LYS . 13.7 pttt -101.35 7.67 42.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.023 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.01 -135.27 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.567 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 13.4 mt-10 -122.71 142.99 50.1 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.794 0.331 . . . . 0.0 110.849 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.561 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.38 124.41 24.52 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.44 0.638 . . . . 0.0 111.7 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -124.28 141.52 44.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.187 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.577 ' HE1' HG22 ' A' ' 85' ' ' VAL . 41.2 m0 -74.09 153.06 39.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.857 0.36 . . . . 0.0 110.89 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.76 -25.7 32.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.189 179.504 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -77.18 -5.62 49.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.597 179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.14 41.83 6.9 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.93 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 2.0 m -139.87 124.26 18.01 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.737 0.303 . . . . 0.0 111.417 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -53.2 150.21 6.28 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.967 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.577 HG22 ' HE1' ' A' ' 79' ' ' TRP . 98.7 t -64.52 117.06 4.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 112.031 -179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -81.4 -47.28 13.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.826 179.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -126.97 115.23 18.92 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.161 178.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.545 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 1.5 p -100.3 169.03 9.4 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.675 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.724 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 70.8 m-20 -133.09 -6.67 3.05 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.568 -179.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.534 ' C ' ' O ' ' A' ' 89' ' ' ASN . 27.0 m0 -12.48 108.39 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.61 0 O-C-N 123.631 0.582 . . . . 0.0 111.762 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.415 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -53.0 111.24 2.49 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.199 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD2' ' CZ ' ' A' ' 112' ' ' ARG . 35.8 Cg_exo -61.38 -30.08 86.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.652 2.234 . . . . 0.0 112.249 -179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.12 28.32 5.66 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.497 -179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -138.92 80.01 25.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.737 0.304 . . . . 0.0 110.831 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_exo -56.42 118.78 5.66 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.678 2.252 . . . . 0.0 112.277 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.2 p -70.36 128.46 36.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.885 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.04 149.36 21.31 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.886 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 98' ' ' ARG . 4.0 ttt180 -76.8 115.2 16.36 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.917 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -158.52 -168.52 2.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.852 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -143.97 146.84 33.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.863 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 172.05 -97.56 0.12 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.494 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.691 ' H ' ' HB3' ' A' ' 117' ' ' PHE . 0.1 OUTLIER -120.6 -159.68 0.8 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 110.885 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -156.34 113.9 3.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.833 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -173.9 159.03 3.3 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.117 0.484 . . . . 0.0 110.954 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.836 HG23 HD12 ' A' ' 68' ' ' LEU . 43.0 t -107.26 135.2 46.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.46 179.106 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.691 ' HB3' HD11 ' A' ' 122' ' ' LEU . 14.1 ptt? -117.87 166.84 12.0 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.014 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.458 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.82 129.7 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.038 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.4 ttm180 171.53 -157.06 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.039 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.26 -109.95 3.06 Favored Glycine 0 C--N 1.332 0.348 0 C-N-CA 120.916 -0.659 . . . . 0.0 112.578 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.443 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 12.6 m -84.06 25.01 0.86 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.863 0.363 . . . . 0.0 110.815 179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.506 ' O ' HG21 ' A' ' 56' ' ' THR . . . 71.91 29.3 67.31 Favored Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.653 -0.784 . . . . 0.0 112.224 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.542 ' CZ ' ' HD2' ' A' ' 92' ' ' PRO . 16.4 ptt180 -124.05 -148.0 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.059 0.457 . . . . 0.0 111.47 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.724 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 25.3 m0 -107.66 162.93 13.52 Favored 'General case' 0 CA--C 1.508 -0.638 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.691 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.511 ' HB2' ' HG3' ' A' ' 106' ' ' MET . 33.8 m-80 -143.35 120.76 11.65 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.558 176.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -99.11 100.19 11.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.26 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.03 162.76 39.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.998 0.427 . . . . 0.0 111.586 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.691 ' HB3' ' H ' ' A' ' 102' ' ' GLU . 0.4 OUTLIER -50.07 -15.87 0.25 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.519 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 23.7 m 74.1 50.88 0.11 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.051 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.58 16.5 2.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.766 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.428 ' O ' ' HB2' ' A' ' 121' ' ' LYS . 15.1 mtt85 -120.87 -32.22 4.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.995 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.428 ' HB2' ' O ' ' A' ' 120' ' ' ARG . 0.0 OUTLIER 68.4 148.48 0.06 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.154 179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.691 HD11 ' HB3' ' A' ' 106' ' ' MET . 5.5 mp -104.35 -155.42 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.919 -179.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.55 25.99 0.46 Allowed Glycine 0 N--CA 1.449 -0.46 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.208 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.62 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -143.88 131.79 21.54 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.993 0.425 . . . . 0.0 111.561 179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 40.1 m0 -98.96 107.84 20.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.213 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 6.8 t -113.1 130.08 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 CA-C-O 121.171 0.51 . . . . 0.0 110.188 179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.429 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -134.85 166.73 22.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.356 -178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -126.31 143.95 50.98 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 179.803 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.522 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 22.9 tpt180 -156.53 147.96 22.45 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.245 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 138.53 57.57 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.819 0.342 . . . . 0.0 110.905 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.562 ' HB1' ' HB3' ' A' ' 5' ' ' CYS . . . -46.71 156.15 0.21 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.728 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 5.4 m -94.47 85.61 4.6 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.872 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.761 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.0 OUTLIER -127.3 144.37 51.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.957 -179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -148.46 80.07 8.57 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.742 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -69.27 112.21 2.93 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.559 2.173 . . . . 0.0 112.295 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.27 7.99 3.1 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.605 2.203 . . . . 0.0 112.448 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -59.34 110.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.112 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 7.8 p -76.34 178.19 6.71 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.872 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 55.98 35.85 26.29 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.046 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.88 115.29 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.487 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 3.2 p -144.24 -28.63 0.5 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.724 0.297 . . . . 0.0 110.875 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.68 28.89 14.84 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.243 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 3.5 pt-20 . . . . . 0 C--O 1.25 1.103 0 CA-C-O 118.23 -0.891 . . . . 0.0 110.902 179.973 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.834 0.35 . . . . 0.0 111.25 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.14 -171.08 30.83 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.525 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 25.2 m-85 -69.08 161.94 27.99 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.858 0.361 . . . . 0.0 110.847 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.441 HG12 HG22 ' A' ' 132' ' ' THR . 3.2 t -105.09 -18.53 6.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.095 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 132' ' ' THR . 83.1 m -66.48 88.01 0.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.812 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -172.38 60.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.005 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -107.2 -6.54 17.24 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.91 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.6 m -115.77 80.72 8.79 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.431 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 61.6 Cg_endo -74.71 -73.52 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.613 2.209 . . . . 0.0 112.583 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.49 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 4.1 tt0 -119.64 -83.31 0.65 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.292 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.704 ' HG3' ' HD1' ' A' ' 12' ' ' TRP . 21.2 pttt -47.69 -40.35 19.86 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.736 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -70.03 143.53 52.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.492 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.535 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.35 126.06 39.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.376 179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.579 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -107.1 152.15 24.42 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.308 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.41 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 4.7 m-85 -130.74 -129.47 0.2 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.062 -179.594 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -49.24 -45.03 44.13 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.057 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.18 -1.68 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.439 179.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.403 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.57 158.39 20.85 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-O 121.514 0.673 . . . . 0.0 110.926 179.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.577 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.2 t -124.58 166.34 16.27 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.951 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.684 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.16 131.48 53.54 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.068 -179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -97.78 109.47 22.22 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 178.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.593 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.89 120.69 37.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.918 -178.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -127.19 173.27 18.51 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.807 -0.711 . . . . 0.0 113.09 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.1 ttpt -139.25 153.22 47.79 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.94 0.4 . . . . 0.0 110.875 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 79.1 100.02 0.24 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.754 179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -158.01 -158.11 0.7 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.711 0.291 . . . . 0.0 110.826 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 1.2 ttmt -112.61 -93.21 0.47 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.265 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.467 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 6.9 mt-30 -123.24 -169.78 2.0 Allowed 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.775 0.322 . . . . 0.0 111.095 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.46 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -60.5 -49.34 77.94 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.931 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.12 -31.28 25.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.709 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -72.4 -32.14 66.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.571 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.436 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.94 -49.07 49.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.751 179.817 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.85 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.7 ptm180 -59.91 -38.97 83.84 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.825 179.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -72.43 -30.43 64.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.938 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.88 -40.34 68.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.334 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.2 m -75.88 -27.64 57.82 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.218 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.421 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 2.3 t0 -74.97 -24.3 58.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.968 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.26 -39.67 79.83 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.447 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -179.55 -26.89 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.481 -179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.785 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 36.6 mm-40 -47.19 -87.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.471 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.665 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -156.27 -95.67 0.11 Allowed Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.438 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.521 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.5 tt0 -154.58 162.28 41.21 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.85 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.7 tp -74.24 112.85 10.8 Favored 'General case' 0 N--CA 1.433 -1.283 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.86 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.54 -70.93 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 113.658 -1.61 . . . . 0.0 114.124 -177.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.706 ' N ' ' H ' ' A' ' 67' ' ' GLY . 38.8 t 65.51 46.56 2.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.283 0.563 . . . . 0.0 109.509 -178.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.812 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -39.21 137.54 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.03 -0.986 . . . . 0.0 111.847 -179.08 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -131.43 1.25 4.11 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.803 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.3 m -119.83 122.33 29.17 Favored Pre-proline 0 N--CA 1.453 -0.315 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.22 179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -45.72 -29.5 5.56 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 122.29 1.994 . . . . 0.0 111.689 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.482 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.1 tt0 -73.3 -45.79 53.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.899 179.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.577 ' HB2' HG22 ' A' ' 46' ' ' ILE . 55.5 mt-10 -65.07 -43.09 93.31 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.657 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.661 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.24 -41.12 94.65 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.035 0.445 . . . . 0.0 109.893 179.148 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.661 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.7 t70 -67.84 -34.53 76.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.619 178.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.482 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.34 70.23 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.466 -179.035 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.24 -34.91 63.78 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.101 178.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.594 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.91 -39.68 90.29 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.514 -0.767 . . . . 0.0 109.421 179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.75 -35.05 60.3 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 108.952 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.571 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 20.7 t-80 -66.36 -30.82 71.29 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.751 178.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.507 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -84.08 93.01 8.02 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.899 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.59 -75.01 0.06 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -123.12 18.28 9.97 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.799 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.507 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 12.7 p -134.99 100.97 4.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.887 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.702 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -51.47 167.35 0.66 Allowed Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.902 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.419 ' HA ' ' O ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.48 161.98 17.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.611 0.243 . . . . 0.0 110.506 179.937 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.626 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.83 132.5 52.72 Favored 'General case' 0 CA--C 1.517 -0.311 0 CA-C-O 120.914 0.388 . . . . 0.0 110.605 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.86 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -109.94 165.79 5.43 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.872 -0.604 . . . . 0.0 111.539 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.706 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -78.59 54.46 4.07 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 115.43 -0.804 . . . . 0.0 112.824 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.91 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -127.17 127.34 44.37 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.159 0.504 . . . . 0.0 112.234 -179.899 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.46 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.1 121.29 16.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.729 178.218 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.578 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 6.2 t-20 -87.38 149.64 24.34 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.947 0.403 . . . . 0.0 111.177 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 6.1 mt -68.42 -71.47 0.21 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.85 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -116.94 -173.46 2.4 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.75 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HG ' ' H ' ' A' ' 74' ' ' LYS . 0.3 OUTLIER -65.21 -54.41 29.98 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.87 179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.467 ' H ' ' HG ' ' A' ' 73' ' ' LEU . 35.3 mttm -101.15 7.72 43.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.843 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.9 -144.83 0.22 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.451 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -123.87 138.23 54.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.873 0.368 . . . . 0.0 111.013 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.787 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -75.32 138.81 42.05 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.399 0.619 . . . . 0.0 111.653 -179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.52 141.01 43.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.605 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.586 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 51.6 m0 -75.0 153.57 38.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.982 0.42 . . . . 0.0 111.464 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.724 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.0 OUTLIER -59.44 -26.9 35.65 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.143 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.738 179.658 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -77.1 3.26 12.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.58 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.47 42.74 21.66 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.73 179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -139.9 118.82 12.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.727 0.299 . . . . 0.0 111.066 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -51.23 141.07 15.43 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.566 HG22 ' NE1' ' A' ' 79' ' ' TRP . 25.2 t -58.78 152.14 4.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.062 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -116.04 -78.88 0.58 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.805 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.97 -41.9 58.64 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -178.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.438 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.2 OUTLIER 53.94 174.41 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.318 -178.735 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.73 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 55.8 m-20 -142.39 -8.05 0.88 Allowed 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -178.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.55 ' C ' ' O ' ' A' ' 89' ' ' ASN . 31.5 m0 -9.33 103.74 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.692 0 O-C-N 123.409 0.443 . . . . 0.0 111.963 179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.48 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -53.57 110.7 2.19 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.411 -0.358 . . . . 0.0 111.309 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -65.41 91.24 0.22 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.643 2.229 . . . . 0.0 112.137 179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 156.55 -16.26 0.4 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.455 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -119.12 78.44 17.45 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 120.714 0.292 . . . . 0.0 110.901 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.76 -10.66 26.8 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.534 2.156 . . . . 0.0 112.363 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.41 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.52 -166.51 0.12 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.922 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.41 ' H ' HG22 ' A' ' 96' ' ' THR . 20.7 m -101.88 -177.82 3.53 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.861 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -118.66 95.2 4.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.868 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -134.72 160.1 39.23 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.938 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 9.3 pt20 -97.84 141.25 31.06 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.897 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 152.96 -137.9 6.07 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.679 -0.772 . . . . 0.0 112.549 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -69.36 164.55 22.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.767 0.318 . . . . 0.0 111.007 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.471 ' CB ' ' HB3' ' A' ' 70' ' ' ASN . 0.0 OUTLIER -148.38 113.28 5.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.663 179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.493 ' N ' ' SG ' ' A' ' 118' ' ' CYS . 0.1 OUTLIER -149.91 149.55 30.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.071 0.463 . . . . 0.0 110.935 -179.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.91 HG21 HD13 ' A' ' 68' ' ' LEU . 52.0 t -102.03 134.9 41.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.725 179.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.615 ' HB3' HD11 ' A' ' 122' ' ' LEU . 2.3 ptt? -118.18 166.42 12.61 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.442 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.523 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.51 130.61 52.1 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.332 -179.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.63 -81.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.749 0.309 . . . . 0.0 111.694 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.424 ' O ' ' HG2' ' A' ' 112' ' ' ARG . . . -46.43 133.04 11.21 Favored Glycine 0 C--N 1.331 0.286 0 CA-C-N 116.042 -0.526 . . . . 0.0 113.41 -179.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.502 ' HB2' ' HD2' ' A' ' 112' ' ' ARG . 5.5 m 56.68 26.33 11.13 Favored 'General case' 0 C--N 1.333 -0.151 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 179.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.576 ' O ' HG21 ' A' ' 56' ' ' THR . . . 51.18 42.13 48.28 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.718 179.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.502 ' HD2' ' HB2' ' A' ' 110' ' ' SER . 6.5 ptp180 -142.78 -144.57 0.16 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.959 0.409 . . . . 0.0 111.191 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.73 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.2 m0 -108.47 163.62 13.06 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.349 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -145.22 119.62 9.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.54 -1.209 . . . . 0.0 108.675 175.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 5.0 t70 -90.45 111.82 23.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.861 -0.609 . . . . 0.0 109.761 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.498 ' C ' ' H ' ' A' ' 118' ' ' CYS . . . -149.85 164.25 35.86 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 121.059 0.456 . . . . 0.0 111.678 -178.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.494 ' CD1' ' HB2' ' A' ' 119' ' ' ASP . 0.1 OUTLIER -69.0 29.55 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.941 -179.765 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.498 ' H ' ' C ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER 53.42 29.77 9.38 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 122.415 0.286 . . . . 0.0 111.709 179.373 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.494 ' HB2' ' CD1' ' A' ' 117' ' ' PHE . 18.1 t70 -77.26 -2.72 36.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.909 0.385 . . . . 0.0 110.781 179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -102.53 -162.17 0.9 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.863 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -158.15 121.64 3.97 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.702 HD23 ' HA3' ' A' ' 63' ' ' GLY . 5.5 mp -88.91 -149.79 0.19 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.63 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.464 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -160.6 14.53 0.18 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.32 -0.943 . . . . 0.0 113.355 -179.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -147.39 134.27 20.17 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 117.06 0.43 . . . . 0.0 111.281 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -106.61 116.97 32.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.246 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.594 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.08 137.55 44.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.692 -178.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.7 m -137.89 165.93 25.3 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.428 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.407 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 5.4 p-10 -125.75 143.79 50.9 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 121.148 0.499 . . . . 0.0 110.336 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.665 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 17.9 tpt180 -157.27 151.57 24.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.165 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.425 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 133.48 50.32 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -50.26 163.08 0.17 Allowed 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.729 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.453 ' O ' ' HA ' ' A' ' 5' ' ' CYS . 40.2 m -94.6 86.66 4.85 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.894 -179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 8.0 m -126.75 177.04 6.81 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 76.6 p -88.51 148.41 42.04 Favored Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.885 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.46 114.32 3.23 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.538 2.159 . . . . 0.0 112.239 -179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -55.13 105.36 0.14 Allowed 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.552 2.168 . . . . 0.0 112.35 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -85.88 -66.95 0.85 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.069 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -104.98 139.59 39.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.828 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.65 149.12 50.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.874 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -68.84 118.7 9.14 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.525 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.3 p -107.95 -64.24 1.23 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.685 0.279 . . . . 0.0 110.828 -179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 58.99 -90.72 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.279 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.859 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.827 0.346 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.99 94.53 1.97 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.503 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -92.16 122.65 34.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.842 0.353 . . . . 0.0 110.879 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 2.2 m -118.52 -46.04 3.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.132 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -166.44 -165.49 0.77 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.983 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -145.33 57.79 1.26 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.855 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 t -91.51 16.52 10.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.912 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.783 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.3 m -117.74 85.06 21.24 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.511 -179.619 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.545 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.3 Cg_endo -78.25 -66.4 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.68 2.253 . . . . 0.0 112.713 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.484 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -123.57 -78.32 0.6 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.195 -179.802 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 7.1 mtpt -52.77 -45.99 67.36 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.78 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.783 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 21.9 m95 -71.12 137.68 49.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.219 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.63 126.19 57.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.707 0.289 . . . . 0.0 111.559 -179.501 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.602 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -105.66 152.28 23.34 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.43 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 4.7 m-85 -130.51 -128.0 0.2 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.926 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -50.88 -45.55 60.08 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-O 120.733 0.302 . . . . 0.0 111.023 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.29 -1.75 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.317 179.772 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.34 20.87 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-O 121.529 0.681 . . . . 0.0 110.859 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.58 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 16.9 t -124.23 166.26 16.18 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-N 114.822 -1.081 . . . . 0.0 109.771 179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.721 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -124.23 134.36 53.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.946 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -97.92 109.48 22.23 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.68 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.4 m-30 -101.11 125.56 47.74 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.376 -0.829 . . . . 0.0 111.174 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -142.17 -169.15 12.0 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.546 -179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.9 tttm -128.43 153.11 47.45 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.427 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 162.7 128.01 0.92 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.536 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.1 m -93.87 118.58 31.66 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.807 0.337 . . . . 0.0 111.032 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.526 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -170.06 -141.76 0.03 OUTLIER 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.669 179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.411 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 40.3 mt-30 -117.75 173.54 6.68 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.701 0.286 . . . . 0.0 110.861 180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.505 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 77.2 t90 -61.46 -47.43 85.71 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.897 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.5 m -55.26 -30.97 25.73 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.029 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.51 -32.45 68.21 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.761 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.9 -48.96 50.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.772 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.877 ' HA ' HD13 ' A' ' 43' ' ' LEU . 2.6 ptm180 -60.93 -38.25 85.15 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.876 179.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -30.02 64.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.829 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.65 -40.93 69.37 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.105 -179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.6 m -74.92 -28.0 60.43 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.198 179.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -74.85 -23.87 58.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.755 -0.657 . . . . 0.0 111.023 179.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.39 -39.62 80.16 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.351 -179.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER 179.88 -26.7 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.54 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 40.6 mm-40 -46.71 -87.42 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.434 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -157.8 -94.09 0.1 OUTLIER Glycine 0 C--N 1.33 0.241 0 C-N-CA 120.279 -0.962 . . . . 0.0 113.41 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.509 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -154.33 162.25 41.28 Favored 'General case' 0 CA--C 1.509 -0.615 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 -178.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.877 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.35 112.93 11.01 Favored 'General case' 0 N--CA 1.433 -1.306 0 N-CA-C 106.735 -1.58 . . . . 0.0 106.735 178.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.98 -71.37 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 113.502 -1.681 . . . . 0.0 114.459 -177.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.689 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 65.41 60.04 0.77 Allowed 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 -178.141 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.88 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -50.53 133.46 10.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.708 -178.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 -123.47 -2.3 8.48 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.757 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -121.2 121.39 28.66 Favored Pre-proline 0 N--CA 1.452 -0.372 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.19 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.51 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.1 Cg_exo -46.02 -29.07 5.78 Favored 'Trans proline' 0 N--CA 1.462 -0.339 0 C-N-CA 122.348 2.032 . . . . 0.0 111.596 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.461 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.6 tt0 -73.36 -45.69 53.56 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.691 178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 59.7 mt-10 -63.75 -44.1 94.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.64 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.586 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -63.41 -41.29 98.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.91 179.518 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -67.7 -35.02 78.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.67 178.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.461 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.14 -51.09 71.06 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.766 -179.024 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.88 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.06 -38.16 64.03 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.8 179.605 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.51 -38.76 85.41 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 2.3 mmpt? -74.72 -35.61 62.68 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.177 178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.5 t-80 -67.99 -30.52 69.8 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.352 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.496 ' HB1' ' H ' ' A' ' 63' ' ' GLY . . . -63.34 121.86 14.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.184 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 p -61.78 -45.38 94.13 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.864 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -94.49 12.94 25.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.785 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 55.83 50.81 13.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.003 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.631 ' HA2' ' O ' ' A' ' 107' ' ' MET . . . -158.42 107.61 0.33 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.558 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.711 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -121.05 162.91 19.17 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.543 0.211 . . . . 0.0 110.564 179.846 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.604 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -107.38 132.6 52.98 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.539 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.874 HG22 HD11 ' A' ' 46' ' ' ILE . 0.7 OUTLIER -111.45 165.95 6.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.778 -0.646 . . . . 0.0 111.686 -179.191 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.689 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.72 54.1 3.71 Favored Glycine 0 N--CA 1.448 -0.516 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.873 -179.62 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.891 HD13 HG21 ' A' ' 105' ' ' VAL . 0.4 OUTLIER -126.4 126.97 44.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.056 0.455 . . . . 0.0 111.927 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.505 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.08 121.9 17.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.025 178.704 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.57 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 3.0 t30 -84.9 152.77 23.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.945 0.402 . . . . 0.0 111.015 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.05 -89.48 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.451 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -139.4 94.76 2.83 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.79 0.329 . . . . 0.0 111.385 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.482 HD23 ' HA3' ' A' ' 101' ' ' GLY . 4.1 mp 56.29 -92.64 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.63 179.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 ptpp? -76.06 7.39 4.14 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.427 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.58 -171.86 10.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.429 179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -99.89 135.28 41.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 0.0 110.473 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.659 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -70.69 120.44 16.31 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.588 0.708 . . . . 0.0 111.671 -179.48 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.71 141.32 42.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.483 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.584 ' NE1' HG22 ' A' ' 85' ' ' VAL . 54.4 m0 -74.74 151.2 39.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.944 0.402 . . . . 0.0 111.045 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.732 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.1 p -59.19 -25.26 29.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.707 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.2 -0.81 26.52 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.551 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 81.73 42.18 9.22 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.813 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -141.4 120.53 12.93 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.706 0.289 . . . . 0.0 111.227 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -51.48 147.27 6.28 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.584 HG22 ' NE1' ' A' ' 79' ' ' TRP . 42.4 t -64.71 151.62 9.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.584 -179.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -113.92 -78.88 0.58 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.4 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -72.44 -56.35 5.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.68 -179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.41 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.2 141.27 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.851 -179.262 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.592 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 1.2 t-20 -88.51 -39.96 13.78 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.529 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.441 ' C ' ' O ' ' A' ' 89' ' ' ASN . 16.9 m0 26.0 85.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 179.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.692 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -56.41 123.48 56.22 Favored Pre-proline 0 C--N 1.327 -0.38 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.124 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -84.72 0.48 8.99 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.76 2.307 . . . . 0.0 112.47 -179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -84.8 4.57 84.72 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.761 -0.733 . . . . 0.0 112.598 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 9.6 tt0 -156.78 77.8 4.05 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.729 0.299 . . . . 0.0 110.97 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -72.47 97.52 0.88 Allowed 'Trans proline' 0 C--N 1.345 0.394 0 C-N-CA 122.596 2.197 . . . . 0.0 112.281 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.447 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 56.27 -165.78 0.13 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.042 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.447 ' H ' HG22 ' A' ' 96' ' ' THR . 5.0 t -150.77 -58.26 0.17 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.918 -179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -158.14 -55.08 0.07 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.884 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 26.1 p -156.3 24.39 0.36 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.858 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.573 ' HG2' ' HB1' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -72.86 92.74 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.996 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.482 ' HA3' HD23 ' A' ' 73' ' ' LEU . . . -69.4 148.92 47.94 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.436 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.433 ' N ' ' HA ' ' A' ' 73' ' ' LEU . 12.7 mt-10 -75.08 128.98 36.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.925 0.393 . . . . 0.0 111.207 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -147.54 -33.99 0.26 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.361 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -145.81 144.32 30.2 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.038 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.891 HG21 HD13 ' A' ' 68' ' ' LEU . 55.8 t -108.7 127.38 65.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-O 121.078 0.466 . . . . 0.0 111.145 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.654 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -125.04 168.8 12.84 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.791 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.711 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.05 130.01 52.91 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.448 179.654 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.4 ' HB2' ' O ' ' A' ' 107' ' ' MET . 0.0 OUTLIER 176.67 -20.3 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.127 -179.917 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -51.49 -70.89 0.75 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.907 -0.663 . . . . 0.0 112.742 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 m -150.34 47.15 0.9 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.786 0.326 . . . . 0.0 110.675 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.443 ' O ' HG21 ' A' ' 56' ' ' THR . . . 91.38 -9.27 77.78 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.736 -179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.692 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 1.6 ptp180 -112.13 -154.82 0.55 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 0.0 110.759 179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.592 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 8.8 m0 -109.13 162.23 14.46 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.644 0.735 . . . . 0.0 112.259 -179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -133.89 119.83 19.62 Favored 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 174.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -87.52 104.27 16.32 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.734 -178.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' A' ' 100' ' ' GLN . . . -157.18 161.5 39.3 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.177 -179.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -48.79 160.75 0.16 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.664 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 2.0 m -73.91 71.71 1.55 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.898 0.38 . . . . 0.0 111.097 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -112.12 -32.18 6.64 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.371 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 148.76 37.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.478 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.33 108.91 17.54 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.085 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.654 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.7 mp -85.09 -163.56 0.85 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.544 179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -158.6 29.88 0.45 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.253 -0.975 . . . . 0.0 113.175 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.581 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -143.2 130.15 20.58 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.135 0.493 . . . . 0.0 111.966 179.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 32.6 m0 -100.76 101.51 12.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.311 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.643 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.0 t -112.65 129.91 67.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 CA-C-O 121.15 0.5 . . . . 0.0 110.414 -179.853 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.441 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 m -137.79 166.73 23.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.277 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -126.05 143.18 51.21 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 121.157 0.503 . . . . 0.0 110.466 179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.432 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 0.1 OUTLIER -157.86 156.55 31.62 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.062 179.944 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -69.1 132.89 47.31 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.553 179.49 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.03 87.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.691 -179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.7 p -131.97 109.91 10.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.877 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 2.2 m -83.18 -5.64 59.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.945 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.1 p -127.18 72.2 76.63 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -73.82 154.31 48.52 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.635 2.223 . . . . 0.0 112.292 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.93 87.06 0.46 Allowed 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.539 2.159 . . . . 0.0 112.296 179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -90.99 -14.13 32.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.141 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.8 m -70.94 132.45 45.22 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.954 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -89.29 4.24 49.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.916 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -71.7 97.18 0.7 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.726 -0.749 . . . . 0.0 112.51 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.72 102.75 2.05 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.859 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.16 -166.8 0.13 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.243 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.915 -179.979 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.849 0.357 . . . . 0.0 111.226 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.7 74.7 0.4 Allowed Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.52 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -83.81 145.6 28.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.714 0.293 . . . . 0.0 110.97 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.73 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 15.2 m -81.7 -173.68 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.067 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 60.2 m 55.07 69.03 0.78 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.933 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -165.34 50.2 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.024 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 t -95.41 1.65 54.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.902 179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.726 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -114.27 86.05 11.39 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.512 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.521 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 72.7 Cg_endo -76.91 -65.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.551 2.167 . . . . 0.0 112.7 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.464 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 9.0 tt0 -130.96 -79.55 0.53 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.262 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.8 mttt -51.0 -36.01 37.01 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.045 -179.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.726 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 22.1 m95 -70.83 146.67 49.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.554 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.522 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.72 125.95 31.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.427 -0.352 . . . . 0.0 111.454 -179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.639 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -109.34 151.48 26.55 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.836 0.35 . . . . 0.0 111.268 179.92 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.513 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.57 -128.01 0.23 Allowed 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.902 -179.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.633 ' HG3' ' HD3' ' A' ' 17' ' ' ARG . 0.8 OUTLIER -49.43 -44.33 45.36 Favored 'General case' 0 C--O 1.231 0.079 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.017 179.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.633 ' HD3' ' HG3' ' A' ' 16' ' ' GLN . 0.0 OUTLIER -167.23 -0.89 0.02 OUTLIER 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.749 179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.77 158.42 20.98 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 121.359 0.6 . . . . 0.0 110.532 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.613 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.9 t -125.13 166.2 16.85 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.118 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.661 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.3 m-30 -124.27 135.15 53.18 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.027 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -98.27 109.52 22.26 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 178.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.658 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.0 m-30 -101.56 128.1 47.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.108 -178.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -148.18 -176.66 21.86 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.799 -0.715 . . . . 0.0 112.428 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.5 OUTLIER -114.37 161.02 18.47 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.856 0.36 . . . . 0.0 110.874 179.9 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -172.57 -164.29 27.79 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.64 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.54 78.15 0.17 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.864 0.364 . . . . 0.0 110.761 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HB3' ' H ' ' A' ' 28' ' ' GLN . 3.7 mmtp -154.24 -139.54 0.08 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.864 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.489 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 11.3 mt-30 -118.38 -175.04 2.79 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.806 0.336 . . . . 0.0 111.01 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.468 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.3 t90 -66.06 -48.04 72.34 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.145 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.8 m -55.03 -31.16 24.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.062 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.402 ' CE1' ' HD2' ' A' ' 27' ' ' LYS . 0.2 OUTLIER -72.26 -31.63 65.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.781 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.96 -48.64 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.809 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.935 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.82 -39.15 87.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.915 179.58 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -72.28 -36.17 68.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.097 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.94 87.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.316 -179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.584 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 9.3 m -76.48 -26.53 55.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.367 179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.3 OUTLIER -74.81 -21.05 59.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.967 179.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.28 -39.44 79.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.399 -179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.9 ptt? -178.14 -27.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.523 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.584 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 49.5 mm-40 -46.19 -89.4 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.487 -179.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.43 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -154.95 -94.77 0.1 Allowed Glycine 0 C--N 1.331 0.254 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.274 -179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.517 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.9 tt0 -153.99 162.34 41.28 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.935 HD22 ' HB3' ' A' ' 33' ' ' ARG . 8.5 tp -73.94 112.94 10.55 Favored 'General case' 0 N--CA 1.433 -1.28 0 N-CA-C 106.511 -1.663 . . . . 0.0 106.511 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.922 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.1 -71.07 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 113.413 -1.722 . . . . 0.0 114.083 -177.45 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.712 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.3 t 64.82 49.17 2.25 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.248 0.547 . . . . 0.0 109.643 -178.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.766 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -42.4 141.33 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.033 -0.985 . . . . 0.0 111.99 -179.275 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -135.4 -0.89 2.63 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.046 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -118.27 124.22 28.78 Favored Pre-proline 0 C--N 1.331 -0.227 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.299 179.715 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -45.97 -30.14 6.82 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.238 1.959 . . . . 0.0 111.605 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.493 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 22.1 tt0 -73.32 -46.31 50.21 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.923 179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.601 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -64.3 -43.14 95.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.745 -179.518 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.613 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -65.3 -40.8 94.29 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.21 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.613 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 15.0 t70 -67.84 -34.4 76.64 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.769 178.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.493 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.11 -51.66 68.66 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.419 -178.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.766 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.44 -34.72 63.27 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.381 0.61 . . . . 0.0 109.796 178.637 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.615 ' OG1' ' HE3' ' A' ' 107' ' ' MET . 0.9 OUTLIER -60.36 -38.81 85.03 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.538 179.752 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.9 tppt? -76.09 -34.51 59.54 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 178.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -64.07 -31.37 72.54 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.069 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.524 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -65.73 108.82 2.22 Favored 'General case' 0 C--O 1.231 0.112 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.024 179.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 42.6 m -62.09 -80.2 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -99.61 -60.49 1.52 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.869 -179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.524 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 0.7 OUTLIER -76.14 -162.73 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.87 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -118.33 -166.83 13.83 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.516 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 p -120.47 162.89 18.79 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.516 0.198 . . . . 0.0 110.616 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.662 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.85 132.65 51.71 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 120.958 0.409 . . . . 0.0 110.529 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.922 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -113.41 166.72 7.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.589 -179.179 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.712 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -76.19 55.21 3.17 Favored Glycine 0 N--CA 1.448 -0.566 0 CA-C-N 115.317 -0.856 . . . . 0.0 113.236 -179.555 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.958 HD11 ' HB3' ' A' ' 77' ' ' PHE . 1.5 tm? -124.04 126.17 45.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.24 0.543 . . . . 0.0 111.942 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.574 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.84 121.59 15.39 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.692 178.155 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.689 ' HB2' ' HB2' ' A' ' 103' ' ' ASP . 2.1 m120 -67.5 151.71 46.91 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.887 0.375 . . . . 0.0 110.819 -179.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.8 -26.8 60.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.88 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -153.64 -73.5 0.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.857 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.545 HD12 ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -158.44 -74.72 0.08 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.692 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.545 ' HG2' HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -101.36 7.58 42.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.91 -115.15 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.693 -179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -127.48 129.06 46.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.878 0.37 . . . . 0.0 111.311 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.958 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -70.95 128.61 36.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.994 179.96 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -120.89 141.43 41.4 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.124 -179.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.455 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 37.9 m0 -74.68 153.14 39.03 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.592 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.757 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -59.99 -26.53 36.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.372 179.605 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -77.19 -4.14 43.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.647 179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.45 41.71 7.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.867 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.5 m -138.59 124.68 20.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.771 0.32 . . . . 0.0 111.286 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 -55.19 150.64 10.6 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.96 0.41 . . . . 0.0 110.97 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.611 HG23 ' O ' ' A' ' 77' ' ' PHE . 12.3 t -61.97 159.7 2.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.339 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' N ' HG12 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -123.97 -69.99 0.78 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.211 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -85.44 -44.59 12.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.414 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.456 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.01 167.61 0.06 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.245 -179.928 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.692 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 85.4 m-20 -144.49 -20.92 0.53 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.519 0.562 . . . . 0.0 112.519 -179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.545 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.2 OUTLIER -35.41 109.83 0.09 Allowed 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.098 0.475 . . . . 0.0 111.415 -178.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.455 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . . . -46.9 114.25 2.74 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.33 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -58.61 -21.08 53.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.567 2.178 . . . . 0.0 112.332 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -87.24 27.37 6.23 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.482 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' HG3' HD22 ' A' ' 114' ' ' ASN . 0.6 OUTLIER -128.66 79.15 74.86 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-O 120.719 0.295 . . . . 0.0 110.818 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -56.77 129.82 36.62 Favored 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.612 2.208 . . . . 0.0 112.308 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.4 t -72.47 147.28 46.22 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.942 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 67.4 m -93.26 -71.47 0.65 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.986 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.0 ptt180 -158.31 156.73 31.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.891 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.3 m -162.05 171.74 17.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.965 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -143.07 -71.47 0.31 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.86 179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.8 176.78 52.56 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.403 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.441 ' HB3' ' HG2' ' A' ' 69' ' ' ARG . 60.7 mt-10 -49.42 117.91 2.45 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.803 0.335 . . . . 0.0 110.888 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.689 ' HB2' ' HB2' ' A' ' 70' ' ' ASN . 1.0 OUTLIER -73.23 177.18 5.29 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.056 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.26 150.12 37.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.655 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.701 HG23 HD12 ' A' ' 68' ' ' LEU . 54.7 t -109.1 141.78 23.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-O 121.251 0.548 . . . . 0.0 111.197 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.912 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.3 OUTLIER -140.13 167.47 22.05 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.9 179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.711 ' HE2' ' N ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -123.04 136.24 54.75 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.018 0.437 . . . . 0.0 110.418 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.711 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.0 OUTLIER 178.28 135.21 0.08 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.814 -179.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 120.63 -123.14 5.47 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.78 179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.5 m -58.9 -31.52 68.69 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.699 0.285 . . . . 0.0 111.242 -179.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.432 ' O ' HG21 ' A' ' 56' ' ' THR . . . 131.95 26.67 0.68 Allowed Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.524 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.567 ' O ' ' HB2' ' A' ' 107' ' ' MET . 0.0 OUTLIER -128.81 -155.59 0.71 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.843 0.354 . . . . 0.0 110.899 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.692 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 36.6 m0 -107.23 161.57 14.66 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 121.548 0.69 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.466 HD22 ' HG3' ' A' ' 94' ' ' GLU . 16.5 m120 -139.61 119.7 13.63 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 114.583 -1.189 . . . . 0.0 107.995 175.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.545 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 27.9 t70 -86.86 120.66 28.38 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.892 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.76 40.07 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.682 -179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 41.7 t80 -38.1 -81.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.164 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 170.54 33.44 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.607 179.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -114.6 59.73 0.69 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.952 -179.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.07 -32.39 3.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.792 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 3.5 mttt 59.37 95.05 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.105 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.912 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.9 mp -85.38 -152.72 0.16 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.579 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.5 26.86 0.22 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.138 -1.03 . . . . 0.0 113.362 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -146.31 131.45 18.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.12 0.486 . . . . 0.0 111.801 179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.53 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 36.7 m0 -99.07 104.87 16.93 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.433 179.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.629 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.4 t -112.8 129.88 67.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.469 0 CA-C-O 121.165 0.507 . . . . 0.0 110.258 179.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.417 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.4 m -136.33 166.66 22.94 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.416 -178.572 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.458 ' HB3' ' HA ' ' A' ' 44' ' ' VAL . 2.6 p-10 -126.16 143.96 50.93 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.127 0.489 . . . . 0.0 110.33 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -157.04 144.41 18.83 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.22 -179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.428 ' N ' HD23 ' A' ' 130' ' ' LEU . 3.8 mt -66.73 144.12 56.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.715 0.293 . . . . 0.0 110.758 179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -42.0 148.49 0.18 Allowed 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.722 -179.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 29.0 m -94.37 96.64 9.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.003 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.73 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 35.3 m -127.48 -179.48 4.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.956 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.4 t -68.01 142.32 95.17 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.851 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -68.73 140.41 46.65 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.555 2.17 . . . . 0.0 112.284 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -74.35 2.8 5.85 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.648 2.232 . . . . 0.0 112.311 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.46 79.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.148 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 92.4 p -82.57 155.78 24.3 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.912 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 56.02 37.66 29.09 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.977 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -84.7 131.47 10.44 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.513 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.77 -35.43 4.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.801 0.334 . . . . 0.0 110.916 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -111.53 69.45 0.69 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.076 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.234 -0.888 . . . . 0.0 110.896 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.758 0.313 . . . . 0.0 111.253 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.12 -156.29 26.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.535 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -148.83 89.37 1.68 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 110.892 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.621 HG21 ' HB3' ' A' ' 131' ' ' ALA . 15.9 m -85.47 -162.74 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.083 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -71.29 -159.63 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.961 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -137.86 61.0 1.61 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.841 -179.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 t -89.21 11.82 17.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.93 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.857 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -118.03 81.63 16.42 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.286 -179.624 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 73.4 Cg_endo -80.38 -63.38 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.696 2.264 . . . . 0.0 112.738 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.46 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 31.6 tt0 -127.28 -80.61 0.6 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.206 -179.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.574 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 13.7 mtpt -51.2 -41.3 60.16 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.961 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.857 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 14.6 m95 -73.73 139.76 45.51 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.486 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -131.86 126.01 56.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.128 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.2 t-20 -106.62 151.97 24.35 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.928 0.394 . . . . 0.0 111.28 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -129.6 -128.26 0.21 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.925 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -50.73 -45.04 58.45 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.02 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.403 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.6 OUTLIER -165.85 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.346 179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.421 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.54 158.03 21.28 Favored 'General case' 0 CA--C 1.513 -0.445 0 CA-C-O 121.574 0.702 . . . . 0.0 110.831 179.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -124.33 166.88 15.16 Favored 'General case' 0 C--N 1.311 -1.097 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.787 179.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.651 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.56 139.09 54.35 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.057 0.456 . . . . 0.0 110.622 -179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -98.0 109.75 22.45 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.724 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.2 m-30 -105.67 114.8 29.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.059 -178.449 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -128.53 179.02 16.85 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.816 -0.707 . . . . 0.0 113.039 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.602 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.7 ptmt -130.92 155.72 46.29 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.913 0.387 . . . . 0.0 110.882 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.97 -123.12 7.36 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.859 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.741 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER 59.44 -165.22 0.2 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.724 0.297 . . . . 0.0 111.159 -179.849 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.9 tttp -128.52 -78.01 0.56 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.225 -179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -122.87 -170.72 2.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.109 -179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.405 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 83.0 t90 -62.31 -49.33 76.07 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.95 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.539 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.6 m -55.11 -31.24 25.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.758 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.741 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.34 -32.79 66.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.606 179.648 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.442 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.86 -49.1 49.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.726 179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.858 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -59.8 -38.83 83.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.88 179.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -72.53 -31.73 65.55 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.157 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 40' ' ' GLU . . . -69.18 -41.05 77.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.442 -179.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.38 -24.03 40.03 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.919 0.39 . . . . 0.0 110.455 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 11.9 t70 -75.18 -23.75 57.74 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.119 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -58.24 -39.98 80.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.474 -179.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 179.14 -26.55 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.518 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.731 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 3.5 mm-40 -45.74 -85.47 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.537 -179.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.534 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -154.99 -99.34 0.17 Allowed Glycine 0 CA--C 1.519 0.307 0 C-N-CA 120.248 -0.977 . . . . 0.0 113.445 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.76 162.35 41.15 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.858 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.8 tp -74.01 112.86 10.55 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 178.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.866 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.27 -69.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 113.63 -1.623 . . . . 0.0 114.108 -177.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.647 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.5 OUTLIER 64.9 47.66 2.57 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.358 0.599 . . . . 0.0 109.518 -178.456 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.674 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.88 143.16 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.069 -179.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -135.92 -0.64 2.53 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.069 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -118.34 123.14 29.56 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.268 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.416 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.6 Cg_exo -46.04 -29.92 6.78 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.302 2.001 . . . . 0.0 111.601 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.458 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.8 tt0 -73.4 -45.86 52.24 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.879 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 53.9 mt-10 -64.89 -42.91 94.39 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.697 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.654 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.03 -40.96 95.59 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.268 -0.423 . . . . 0.0 109.943 179.34 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 23.4 t70 -68.29 -34.53 76.32 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.845 -0.616 . . . . 0.0 109.752 178.664 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.458 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.08 -51.84 67.93 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.422 -178.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.724 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -75.01 -35.23 61.98 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.989 0.423 . . . . 0.0 110.339 179.055 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.667 HG21 ' HA2' ' A' ' 111' ' ' GLY . 0.6 OUTLIER -60.18 -40.29 89.47 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.379 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -74.38 -34.7 63.4 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.455 -0.793 . . . . 0.0 108.956 178.45 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.574 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 3.9 t60 -65.1 -32.4 74.09 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.079 179.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -70.56 108.83 4.52 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.031 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.33 2.41 28.83 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.938 -179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -98.54 -74.62 0.58 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.884 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.553 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 2.7 m -142.98 -38.72 0.34 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.885 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.527 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 171.26 -173.59 44.81 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.543 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.54 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.0 p -122.57 163.01 20.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.536 0.207 . . . . 0.0 110.62 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.665 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -105.73 132.56 51.7 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.976 0.417 . . . . 0.0 110.721 179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.866 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.35 167.48 6.32 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.593 -179.091 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.713 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -77.82 56.54 3.87 Favored Glycine 0 N--CA 1.447 -0.611 0 CA-C-N 115.309 -0.86 . . . . 0.0 112.917 -179.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.974 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.2 tm? -122.61 127.02 48.86 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.353 0.597 . . . . 0.0 112.183 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.589 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.37 120.54 14.73 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.265 177.93 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.467 ' H ' ' HB2' ' A' ' 103' ' ' ASP . 0.0 OUTLIER -88.99 149.22 23.37 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.861 0.363 . . . . 0.0 111.183 -179.575 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.98 -77.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.167 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -110.18 -77.16 0.6 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.973 -179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.7 -51.14 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.895 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 45.6 mttt -100.71 7.46 43.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.89 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.57 -127.27 0.73 Allowed Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.443 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -127.15 142.97 51.37 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.872 0.368 . . . . 0.0 110.864 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.974 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.3 OUTLIER -81.38 124.89 29.77 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.3 -179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -115.42 140.83 35.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.805 -179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.424 ' NE1' ' HA ' ' A' ' 85' ' ' VAL . 42.7 m0 -75.23 151.47 38.41 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.669 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.745 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.42 -25.75 32.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.489 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -77.23 -3.75 41.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.698 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 84.66 41.53 7.71 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.826 179.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.9 t -140.8 125.21 17.66 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.71 0.291 . . . . 0.0 111.168 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 29.0 t60 -58.79 148.01 31.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.994 0.426 . . . . 0.0 110.866 179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.621 HG23 ' O ' ' A' ' 77' ' ' PHE . 6.5 t -54.74 159.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.328 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.438 ' N ' HG12 ' A' ' 85' ' ' VAL . 55.0 m-20 -125.12 -60.24 1.36 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.125 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -92.02 -45.96 8.05 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.316 -179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.508 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 59.95 157.26 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.242 179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.69 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 87.7 m-20 -138.68 -15.11 1.21 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 112.438 0.532 . . . . 0.0 112.438 -179.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.544 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -38.15 110.48 0.13 Allowed 'General case' 0 C--N 1.342 0.257 0 CA-C-O 121.022 0.439 . . . . 0.0 111.149 -179.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.767 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . . . -42.5 134.44 2.69 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.305 -0.861 . . . . 0.0 111.512 -179.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -73.18 -17.99 24.03 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.568 2.178 . . . . 0.0 112.276 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -85.93 12.87 58.67 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.493 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -126.44 76.65 73.4 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 120.669 0.271 . . . . 0.0 110.876 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.6 Cg_endo -71.65 -11.82 28.4 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.611 2.207 . . . . 0.0 112.269 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.466 HG22 ' H ' ' A' ' 97' ' ' SER . 0.2 OUTLIER 58.44 -174.71 0.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.129 -179.952 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.466 ' H ' HG22 ' A' ' 96' ' ' THR . 0.5 OUTLIER -164.82 -172.98 2.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.867 -179.998 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 57.71 -166.64 0.14 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.035 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.4 m -153.3 147.94 26.22 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -160.33 -174.92 4.75 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.817 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -100.19 -16.02 28.8 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.509 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.834 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 16.3 mm-40 -67.87 167.5 13.44 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.689 0.281 . . . . 0.0 110.825 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.467 ' HB2' ' H ' ' A' ' 70' ' ' ASN . 2.3 p-10 -172.65 106.75 0.17 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.092 -179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 16.9 p -161.25 145.59 13.39 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 121.062 0.458 . . . . 0.0 111.545 179.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.775 HG23 HD12 ' A' ' 68' ' ' LEU . 50.0 t -106.26 128.94 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.628 179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.821 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.6 OUTLIER -119.09 170.46 9.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.004 -179.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.54 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.14 130.76 53.88 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.97 0.414 . . . . 0.0 110.374 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.56 -178.69 4.96 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.233 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -73.49 -17.96 79.22 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.568 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 5.7 m -56.01 -45.6 79.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.913 0.387 . . . . 0.0 110.709 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.667 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 127.55 28.41 0.9 Allowed Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.816 -0.707 . . . . 0.0 112.866 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.767 ' HD3' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -150.7 -159.33 1.02 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.105 0.478 . . . . 0.0 111.512 179.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.69 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 37.3 m0 -108.24 161.91 14.56 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.444 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 15.3 m-20 -140.53 119.4 12.59 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.544 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 24.0 t70 -88.02 121.05 29.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.261 -179.181 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.48 161.64 40.03 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.697 ' HB3' ' HB2' ' A' ' 102' ' ' GLU . 16.5 m-85 -44.42 -75.83 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.613 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.834 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.5 OUTLIER 174.36 31.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.765 179.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -84.31 -27.53 27.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.573 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -68.0 124.06 22.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.706 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -99.8 107.71 19.82 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.924 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.821 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp -85.03 -162.99 0.76 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.734 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -154.66 20.05 0.6 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.269 -0.967 . . . . 0.0 113.308 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.602 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.18 131.54 16.59 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 117.078 0.439 . . . . 0.0 111.513 179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.43 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 8.0 p-90 -102.77 114.62 29.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.992 179.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.615 HG12 ' CG2' ' A' ' 44' ' ' VAL . 4.4 t -112.03 136.48 48.08 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.671 -179.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.435 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.98 167.52 21.86 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.79 -178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -126.41 142.52 51.5 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-O 121.127 0.489 . . . . 0.0 110.172 179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.534 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 8.2 tpt180 -158.17 152.69 24.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.911 179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.61 132.52 48.34 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.845 0.355 . . . . 0.0 110.621 179.683 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.621 ' HB3' HG21 ' A' ' 4' ' ' VAL . . . -61.02 92.57 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.548 -179.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 58.7 p -131.66 -173.53 3.15 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.909 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 11.2 m -137.77 -57.12 0.68 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 68.8 p -68.02 141.57 94.44 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.924 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.4 ' HA ' ' HD3' ' A' ' 136' ' ' PRO . 58.7 Cg_endo -71.43 127.5 13.36 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.565 2.177 . . . . 0.0 112.353 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 135' ' ' PRO . 35.1 Cg_exo -57.59 96.6 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.419 0 C-N-CA 122.56 2.173 . . . . 0.0 112.316 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.75 -166.0 0.13 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.185 179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 58.53 -172.33 0.1 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.119 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 55.43 35.57 25.31 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.987 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -81.48 117.92 4.52 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.486 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 m -73.22 127.39 32.49 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.864 0.364 . . . . 0.0 110.868 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.82 87.48 3.33 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.06 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.857 -179.97 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.8 t . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.725 0.298 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 122.3 -137.42 11.4 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.493 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -72.0 159.74 33.7 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.766 0.317 . . . . 0.0 110.905 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.4 t -85.33 126.66 40.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.202 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -89.52 116.98 28.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.824 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -155.7 28.48 0.38 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.935 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.8 t -89.78 4.8 48.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.902 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.785 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.7 m -121.15 76.33 31.52 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.474 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.538 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 66.2 Cg_endo -75.74 -72.45 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.63 2.22 . . . . 0.0 112.527 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.504 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.6 tt0 -117.58 -80.33 0.61 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.122 -179.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.619 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 4.0 mtpt -50.39 -46.11 55.87 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.906 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.785 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.0 m95 -71.7 139.21 49.08 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.391 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.552 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.76 126.07 53.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.46 -179.504 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.611 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.52 152.21 23.97 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.875 0.369 . . . . 0.0 111.253 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -130.55 -128.72 0.2 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.889 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -44.86 56.17 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.552 -0.294 . . . . 0.0 110.989 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 2.6 ptt-85 -165.62 -2.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.477 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.43 158.28 20.86 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 121.531 0.682 . . . . 0.0 110.96 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 11.6 t -124.56 166.26 16.39 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-N 114.916 -1.038 . . . . 0.0 109.995 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.714 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.37 134.77 53.04 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.031 -179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -98.0 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.717 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.5 m-30 -102.05 127.12 49.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.392 -178.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -144.15 -177.71 19.26 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.577 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 5.2 mttt -116.94 162.56 17.57 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.831 0.348 . . . . 0.0 110.965 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.441 ' HA3' ' CE2' ' A' ' 125' ' ' TRP . . . 145.95 129.25 2.04 Favored Glycine 0 C--N 1.33 0.233 0 C-N-CA 120.837 -0.696 . . . . 0.0 112.642 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.5 p -95.85 127.76 42.16 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.772 0.32 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HA ' ' HE2' ' A' ' 121' ' ' LYS . 0.9 OUTLIER -172.88 -143.53 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.724 -179.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -115.74 171.42 7.76 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.714 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.485 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.1 t90 -61.93 -48.14 81.76 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.946 0.403 . . . . 0.0 110.91 179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.534 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -54.99 -31.06 24.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.916 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 19.0 m80 -71.22 -32.5 68.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.811 179.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.98 -48.97 50.34 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.784 0.326 . . . . 0.0 110.806 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.936 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.45 -37.38 83.35 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.948 179.507 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -72.36 -35.89 68.62 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.08 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.71 -40.57 84.28 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.382 -179.819 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.665 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 6.0 m -76.28 -26.52 55.98 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.441 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.503 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.87 -22.32 58.73 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.962 179.756 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -39.45 79.13 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.409 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -178.42 -26.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.566 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.665 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 41.0 mm-40 -46.07 -88.34 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.476 -179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.13 -95.48 0.11 Allowed Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.245 -0.979 . . . . 0.0 113.361 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.53 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.6 tt0 -152.93 162.15 41.67 Favored 'General case' 0 CA--C 1.507 -0.683 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -178.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.936 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.8 tp -73.92 112.77 10.37 Favored 'General case' 0 N--CA 1.434 -1.269 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.905 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -21.35 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 113.411 -1.722 . . . . 0.0 114.258 -177.367 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.735 ' N ' ' H ' ' A' ' 67' ' ' GLY . 1.7 t 66.99 52.61 0.87 Allowed 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.215 0.531 . . . . 0.0 109.799 -178.673 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.743 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.77 144.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.909 -179.175 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 14.9 p80 -135.86 -0.58 2.55 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.936 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -122.72 123.34 26.95 Favored Pre-proline 0 N--CA 1.453 -0.289 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.337 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.542 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 83.6 Cg_exo -46.76 -28.34 6.6 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.364 2.043 . . . . 0.0 111.58 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.1 tt0 -73.32 -46.37 49.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.71 179.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 21.8 mt-10 -64.14 -43.27 95.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.464 -179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.736 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -61.94 -42.98 99.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.014 0.435 . . . . 0.0 109.856 179.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.548 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 13.0 t70 -66.7 -35.11 79.37 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.7 178.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.452 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.63 -51.14 70.68 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.915 -178.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.743 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.4 -40.05 62.28 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.799 179.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.663 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.94 -38.59 82.88 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.995 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.1 OUTLIER -74.15 -34.69 63.92 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 178.381 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.619 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 31.4 t-80 -66.42 -30.79 71.23 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.043 179.169 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.45 114.12 5.86 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.039 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -103.09 5.48 38.0 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.998 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.17 -75.64 0.59 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.866 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 14.5 m -147.26 -40.75 0.18 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.841 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.568 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -178.16 -176.44 46.12 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.491 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 3.1 p -122.78 163.09 20.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.519 0.2 . . . . 0.0 110.494 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.598 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.9 m-90 -104.94 132.47 51.14 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.744 -0.383 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.905 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.9 OUTLIER -111.5 166.43 5.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.79 -179.097 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.735 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.04 51.68 3.22 Favored Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 115.289 -0.869 . . . . 0.0 112.649 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.979 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.83 127.07 44.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.089 0.471 . . . . 0.0 111.427 179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.485 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -138.04 121.2 16.83 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.483 178.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.605 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 29.9 t-20 -89.07 148.75 23.55 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.828 ' HB2' ' HB2' ' A' ' 74' ' ' LYS . 10.2 mt -54.5 176.4 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.108 -179.545 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -60.59 80.9 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.955 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.57 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 2.9 mp 50.22 25.71 1.9 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.989 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.828 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 27.3 mttt -76.63 -18.81 58.39 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.233 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.434 ' HA2' ' OE2' ' A' ' 102' ' ' GLU . . . 94.6 -3.82 68.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.709 -0.758 . . . . 0.0 113.37 179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -111.42 122.92 49.12 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 117.198 0.499 . . . . 0.0 110.85 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.767 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -90.17 142.06 28.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.437 0.637 . . . . 0.0 112.551 -179.396 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -140.71 141.13 32.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.295 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.557 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 53.5 m0 -74.34 151.7 39.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.004 0.431 . . . . 0.0 111.495 -179.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.728 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.2 p -59.29 -25.95 32.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.59 179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -77.04 3.02 13.3 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.462 179.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 76.88 42.82 19.43 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.753 179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.0 m -142.73 118.62 10.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.701 0.286 . . . . 0.0 111.097 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -48.03 144.87 3.36 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.021 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.599 HG21 ' CD2' ' A' ' 77' ' ' PHE . 61.3 t -58.68 152.05 4.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.362 -179.756 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 76.1 m-20 -114.8 -77.78 0.57 Allowed 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.814 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -75.27 -47.76 26.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 0.0 112.176 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER 56.7 168.19 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.39 -0.368 . . . . 0.0 110.174 -178.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.736 HD21 ' HG2' ' A' ' 52' ' ' GLN . 57.4 m-20 -128.51 -24.93 2.98 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.791 -0.363 . . . . 0.0 111.754 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.477 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.6 m0 16.36 101.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.452 ' HB1' ' HB2' ' A' ' 94' ' ' GLU . . . -49.53 108.78 1.05 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.354 179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -67.37 126.52 15.06 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 122.769 2.313 . . . . 0.0 112.24 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 60.59 25.87 63.87 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.534 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.452 ' HB2' ' HB1' ' A' ' 91' ' ' ALA . 6.2 mt-10 -136.6 73.87 54.13 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-O 120.687 0.28 . . . . 0.0 110.789 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.32 -75.83 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.525 2.15 . . . . 0.0 112.312 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 54.67 33.79 20.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.988 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.5 p -142.31 112.88 7.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . 0.435 HH11 ' HD2' ' A' ' 98' ' ' ARG . 0.0 OUTLIER -72.87 -28.98 62.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.861 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 41.2 m -86.17 109.29 18.78 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.884 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -60.05 -41.36 92.15 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.927 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.57 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -70.7 134.09 23.69 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.399 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.501 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 1.0 OUTLIER -106.22 149.73 26.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.766 0.317 . . . . 0.0 110.938 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.438 ' HA ' ' O ' ' A' ' 70' ' ' ASN . 0.6 OUTLIER -136.46 -24.07 1.22 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.671 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.417 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 23.9 m -154.97 158.48 39.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.084 179.379 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.979 HG21 HD13 ' A' ' 68' ' ' LEU . 65.7 t -111.33 134.95 52.05 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.22 0.534 . . . . 0.0 111.723 -179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.504 ' CB ' HD11 ' A' ' 122' ' ' LEU . 2.5 ptm -124.72 169.62 11.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.319 -179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.09 130.43 53.75 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.104 0.478 . . . . 0.0 110.438 179.805 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 8.3 mtp180 -88.89 166.7 13.79 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.2 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -61.33 -22.63 61.3 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.318 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.619 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 48.0 m -54.84 -37.31 66.02 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.849 0.356 . . . . 0.0 110.679 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.513 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 116.16 35.28 1.24 Allowed Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.952 179.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.619 ' HD3' ' HB2' ' A' ' 110' ' ' SER . 0.0 OUTLIER -150.18 -163.85 1.88 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.087 0.47 . . . . 0.0 111.419 179.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.728 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 35.0 m0 -108.6 162.44 14.14 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 121.668 0.746 . . . . 0.0 112.112 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -141.16 119.92 12.57 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.147 -1.388 . . . . 0.0 107.729 175.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.49 ' HA ' HG22 ' A' ' 105' ' ' VAL . 22.9 t0 -97.42 99.84 11.27 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.428 -179.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -157.08 161.28 39.45 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.145 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.501 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 17.4 t80 -41.57 135.88 2.0 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.629 179.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.0 OUTLIER -78.64 66.98 4.29 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.866 0.365 . . . . 0.0 111.134 -179.725 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -111.2 -0.93 16.32 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.713 179.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 7.5 mmt180 -92.72 -161.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.806 -179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . 0.562 ' HE2' ' HA ' ' A' ' 27' ' ' LYS . 21.9 ttmt -154.4 115.98 4.15 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.021 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.598 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.5 mp -85.54 -139.61 0.08 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.552 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.49 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -169.11 23.71 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.153 -1.022 . . . . 0.0 113.435 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.558 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.76 130.51 14.13 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.229 0.515 . . . . 0.0 112.02 179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' CE2' ' HA3' ' A' ' 25' ' ' GLY . 38.4 m0 -97.46 105.11 17.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.357 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.634 ' CG1' HG11 ' A' ' 44' ' ' VAL . 5.1 t -113.09 129.83 68.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.163 0.506 . . . . 0.0 110.424 179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.419 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.6 m -136.92 166.87 22.63 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.368 -178.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.9 OUTLIER -126.24 143.54 51.11 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.087 0.47 . . . . 0.0 110.367 179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.38 152.51 25.96 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.033 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.449 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.53 144.22 56.59 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.855 0.359 . . . . 0.0 110.837 179.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -60.45 -166.77 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.783 -179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.3 36.69 1.13 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.957 -179.754 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.38 64.23 1.47 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.88 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.5 t -108.05 141.58 23.44 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.885 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_exo -56.26 120.36 8.16 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.573 2.182 . . . . 0.0 112.293 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -54.84 104.22 0.11 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.545 2.164 . . . . 0.0 112.281 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -82.34 -65.46 1.01 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.076 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -111.69 153.58 26.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -70.01 123.85 22.59 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.89 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -109.28 -27.79 4.63 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.475 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 4.7 p -157.88 -43.22 0.06 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.766 0.317 . . . . 0.0 110.86 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 56.95 -164.98 0.15 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.247 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.304 -0.855 . . . . 0.0 110.863 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.721 0.296 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.17 177.23 23.96 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.879 -0.676 . . . . 0.0 112.544 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -71.04 168.42 17.14 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.757 0.313 . . . . 0.0 110.945 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 19.2 t -69.17 126.1 28.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 132' ' ' THR . 0.1 OUTLIER -141.5 87.62 2.08 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.882 179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -173.2 83.65 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.899 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.37 -3.36 11.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.776 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.8 m -114.52 82.99 8.25 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.526 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.522 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 59.3 Cg_endo -73.53 -75.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.604 2.203 . . . . 0.0 112.579 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.479 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 19.1 tt0 -119.81 -80.41 0.62 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.253 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.599 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.6 OUTLIER -50.14 -37.96 36.95 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.93 -179.753 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.776 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 17.1 m95 -71.82 140.27 49.31 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.509 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.64 125.93 50.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.33 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.85 152.06 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.898 0.38 . . . . 0.0 111.329 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -130.34 -128.81 0.2 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.972 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 43.1 mm-40 -50.04 -45.41 52.16 Favored 'General case' 0 C--O 1.231 0.086 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.075 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.409 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.48 -1.85 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.384 179.737 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.07 21.21 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 121.56 0.695 . . . . 0.0 110.93 179.724 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.571 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.71 166.19 16.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.85 -1.068 . . . . 0.0 109.939 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.712 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.01 132.76 53.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.02 -179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -97.91 109.29 22.08 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.608 ' CD1' HG22 ' A' ' 126' ' ' VAL . 11.8 m-30 -97.99 121.98 40.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.822 -178.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.78 173.75 21.67 Favored Glycine 0 C--N 1.333 0.382 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.422 -179.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.619 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 7.2 ttpt -140.79 153.14 45.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.99 0.424 . . . . 0.0 110.673 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 90.75 87.41 1.38 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.921 -0.657 . . . . 0.0 112.568 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.27 -159.66 1.04 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.685 0.278 . . . . 0.0 110.82 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.5 ' HG2' ' HG3' ' A' ' 28' ' ' GLN . 4.0 ttmm -113.06 -90.88 0.5 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.2 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.5 ' HG3' ' HG2' ' A' ' 27' ' ' LYS . 44.2 mt-30 -123.22 -170.76 2.17 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.824 0.345 . . . . 0.0 111.047 -179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.476 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.6 t90 -58.33 -50.01 75.16 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.893 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.517 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.5 m -55.11 -31.36 25.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.619 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -72.33 -32.41 66.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.662 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.86 -48.49 53.62 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.709 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -62.26 -39.21 92.16 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.066 179.663 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 4.5 t80 -72.57 -38.05 68.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.386 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.26 -39.0 82.35 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.542 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 20.2 m -78.31 -25.76 46.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.525 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 27.6 t70 -75.22 -22.93 57.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.03 179.688 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 39' ' ' MET . 4.6 t70 -58.26 -39.72 79.94 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.621 -179.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.453 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.8 mtp -173.01 -29.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.61 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.618 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 29.7 mm-40 -46.35 -88.17 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.497 -179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.499 ' HA3' ' HB3' ' A' ' 129' ' ' ARG . . . -157.38 -98.01 0.14 Allowed Glycine 0 C--N 1.331 0.292 0 C-N-CA 120.176 -1.011 . . . . 0.0 113.483 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.514 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.3 tt0 -152.04 162.21 41.44 Favored 'General case' 0 CA--C 1.509 -0.619 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 -178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.868 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.6 tp -74.06 112.84 10.59 Favored 'General case' 0 N--CA 1.433 -1.291 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.873 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.37 -71.63 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 113.509 -1.678 . . . . 0.0 114.223 -177.386 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.687 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 64.55 50.6 2.13 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -178.293 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.827 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -41.35 136.82 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.979 -178.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.426 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 20.1 p-80 -129.2 -0.04 5.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.747 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.512 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 9.3 m -119.92 122.6 28.93 Favored Pre-proline 0 N--CA 1.453 -0.311 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.358 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -46.12 -29.57 6.59 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 122.255 1.97 . . . . 0.0 111.508 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.5 tt0 -73.37 -45.84 52.54 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.874 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' HB2' HG22 ' A' ' 46' ' ' ILE . 61.5 mt-10 -63.95 -43.81 94.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.787 -179.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.587 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.07 -40.23 95.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.044 0.449 . . . . 0.0 109.962 179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.587 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 31.0 t0 -68.69 -34.79 76.26 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.635 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.49 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.63 -51.19 70.85 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.542 -179.013 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.822 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -73.91 -33.04 63.82 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.073 179.123 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.4 OUTLIER -60.72 -41.81 96.03 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.611 179.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 18.8 mtmt -73.96 -35.13 64.49 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.573 -0.739 . . . . 0.0 109.267 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.599 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 34.3 t-80 -68.67 -30.47 69.16 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.08 179.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.6 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -78.77 86.13 4.72 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.086 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -89.58 -53.3 4.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.998 -179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -65.5 -51.57 59.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.964 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.6 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -150.53 161.97 41.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.928 179.946 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -59.61 178.99 2.15 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.974 -179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.407 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -116.93 162.43 17.78 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.399 -0.222 . . . . 0.0 110.399 179.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.658 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.4 m-90 -105.1 132.42 51.36 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.422 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.873 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -111.16 166.82 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.765 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.687 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -75.34 55.27 2.81 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.72 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.917 HD11 ' HB2' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -125.48 128.0 47.35 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.459 0.647 . . . . 0.0 112.482 -179.723 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.62 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -138.22 121.15 16.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.38 177.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -96.23 139.07 32.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.877 0.37 . . . . 0.0 111.128 -179.589 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 5.6 mp -68.7 129.06 38.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.146 -179.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 55.85 -97.01 0.07 Allowed 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.171 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.523 ' O ' ' HB2' ' A' ' 102' ' ' GLU . 0.3 OUTLIER -163.18 -39.77 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.844 0.354 . . . . 0.0 111.002 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.33 7.6 42.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.937 -179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.15 -136.63 1.6 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.518 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -127.21 147.11 50.21 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.785 0.326 . . . . 0.0 110.71 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.917 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -73.79 132.72 42.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.443 0.64 . . . . 0.0 111.729 -179.809 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.415 HD11 ' CE1' ' A' ' 84' ' ' HIS . 0.0 OUTLIER -131.67 141.72 44.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.319 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.474 ' HE1' HG22 ' A' ' 85' ' ' VAL . 33.1 m0 -73.93 150.53 40.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.805 0.336 . . . . 0.0 110.457 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.707 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.65 -24.06 27.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.183 0.516 . . . . 0.0 110.291 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -77.2 -5.6 49.83 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.493 179.724 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.93 41.7 6.61 Favored Glycine 0 N--CA 1.448 -0.512 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.963 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -141.12 122.79 15.2 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.664 0.269 . . . . 0.0 111.471 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.415 ' CE1' HD11 ' A' ' 78' ' ' ILE . 52.7 m-70 -53.22 152.05 4.72 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.85 0.357 . . . . 0.0 110.931 179.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.68 ' CG2' HD21 ' A' ' 68' ' ' LEU . 84.0 t -63.96 153.79 7.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.615 -179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -115.89 -70.9 0.77 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.745 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -84.13 -44.1 14.35 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.21 165.28 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.035 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.691 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 62.4 m-20 -131.64 -23.09 2.35 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.493 ' C ' ' O ' ' A' ' 89' ' ' ASN . 34.8 m0 13.33 101.79 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.821 0.675 . . . . 0.0 112.821 179.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.581 ' HB2' ' HG3' ' A' ' 112' ' ' ARG . . . -54.34 124.21 46.24 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 120.704 0.288 . . . . 0.0 111.036 179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -84.02 15.53 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.442 0 C-N-CA 122.685 2.257 . . . . 0.0 112.493 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.04 -2.39 90.63 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.562 -179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -147.67 79.33 9.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 120.742 0.306 . . . . 0.0 111.039 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.17 -48.11 0.93 Allowed 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.544 2.163 . . . . 0.0 112.214 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 47.1 p -91.74 142.19 27.86 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.824 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 34.5 p -157.64 141.71 16.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.991 -179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -92.62 -2.36 56.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.899 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 55.4 p -118.78 127.69 53.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.912 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -102.29 27.48 6.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.876 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -76.36 125.56 7.74 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.516 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.57 ' HG3' ' HA ' ' A' ' 116' ' ' ALA . 0.3 OUTLIER -153.57 104.46 2.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.834 0.35 . . . . 0.0 110.833 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -127.38 -21.88 3.78 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.023 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.492 ' HB2' ' HB3' ' A' ' 118' ' ' CYS . 24.1 m -154.95 158.18 38.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.035 0.445 . . . . 0.0 110.282 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.699 HG23 HD12 ' A' ' 68' ' ' LEU . 51.9 t -109.01 135.37 48.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.867 179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.706 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.3 ptt? -118.15 166.93 11.98 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.011 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.511 ' H ' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -124.91 129.56 50.62 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.179 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 107' ' ' MET . 2.7 ptm180 171.87 -159.54 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.033 -179.726 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 63.18 -107.78 1.86 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.958 -0.639 . . . . 0.0 112.649 179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.467 ' HB2' ' CD ' ' A' ' 112' ' ' ARG . 6.6 m -84.96 29.66 0.62 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.844 0.354 . . . . 0.0 111.041 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.54 ' O ' HG21 ' A' ' 56' ' ' THR . . . 65.46 30.82 78.46 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.4 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.581 ' HG3' ' HB2' ' A' ' 91' ' ' ALA . 3.6 ptp180 -127.47 -148.24 0.38 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.064 0.459 . . . . 0.0 111.375 -179.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.691 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 28.0 m0 -107.67 161.73 14.61 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 121.579 0.704 . . . . 0.0 112.015 -179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 106' ' ' MET . 3.8 t-20 -141.57 120.92 13.13 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.43 -1.259 . . . . 0.0 108.359 175.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -98.59 97.3 8.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.626 -179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.57 ' HA ' ' HG3' ' A' ' 102' ' ' GLU . . . -157.93 161.25 38.19 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.063 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -43.93 128.22 5.55 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.039 179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 104' ' ' CYS . 0.5 OUTLIER -75.14 77.52 2.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.99 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.86 55.37 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.129 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.464 ' HD2' ' O ' ' A' ' 27' ' ' LYS . 0.0 OUTLIER 54.57 96.77 0.02 OUTLIER 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.544 179.604 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.48 -14.66 1.47 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.961 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.706 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.1 mp -114.69 -161.6 0.78 Allowed 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.901 0.381 . . . . 0.0 111.354 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.67 11.6 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.877 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.619 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -129.37 139.01 51.85 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-N 116.852 0.326 . . . . 0.0 110.642 179.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.441 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 0.9 OUTLIER -109.78 117.91 35.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.304 0.574 . . . . 0.0 111.091 -179.729 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.608 HG22 ' CD1' ' A' ' 22' ' ' PHE . 2.9 t -112.56 135.57 51.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 CA-C-N 115.276 -0.875 . . . . 0.0 110.266 -179.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.17 165.14 26.43 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.731 -178.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -126.72 143.98 51.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.225 0.536 . . . . 0.0 110.425 179.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.499 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -156.91 171.54 20.26 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.999 -179.994 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -84.59 136.94 33.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.816 0.341 . . . . 0.0 110.813 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -52.78 170.84 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.769 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.811 HG23 ' HG2' ' A' ' 136' ' ' PRO . 75.5 m -94.41 103.82 15.8 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.957 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.403 ' H ' ' H ' ' A' ' 134' ' ' THR . 0.1 OUTLIER -166.58 -10.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.849 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.562 ' H ' ' HD2' ' A' ' 135' ' ' PRO . 0.0 OUTLIER -162.08 -52.49 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.411 -179.95 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 134' ' ' THR . 71.0 Cg_exo -48.16 -47.98 17.97 Favored 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 122.33 2.02 . . . . 0.0 113.208 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.811 ' HG2' HG23 ' A' ' 132' ' ' THR . 45.7 Cg_exo -56.55 137.74 81.88 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.046 1.831 . . . . 0.0 112.314 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.2 40.13 30.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.207 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -147.38 -64.5 0.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.866 179.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 56.33 40.76 29.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.051 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -82.75 117.12 4.34 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.458 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.16 -53.23 0.42 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.851 0.358 . . . . 0.0 110.949 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -104.57 27.19 8.16 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.156 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.957 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.866 0.365 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 179.67 -60.58 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.551 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.86 121.33 33.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.749 0.309 . . . . 0.0 110.975 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.3 t -107.45 -51.92 7.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.098 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.479 ' HB3' ' H ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -150.53 -96.3 0.06 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.897 179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.479 ' H ' ' HB3' ' A' ' 5' ' ' CYS . 1.8 t-20 -175.98 52.36 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.856 0.36 . . . . 0.0 110.832 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.533 ' C ' ' HD3' ' A' ' 9' ' ' PRO . 0.7 OUTLIER -87.35 1.23 53.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.087 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.594 ' SG ' ' HB2' ' A' ' 14' ' ' ASN . 9.2 m -119.43 67.23 9.64 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 111.897 0.332 . . . . 0.0 111.897 -179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' HD3' ' C ' ' A' ' 7' ' ' THR . 73.8 Cg_endo -90.18 -81.36 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 123.035 2.49 . . . . 0.0 111.565 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -101.29 138.69 37.97 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.108 -0.496 . . . . 0.0 109.686 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 10.3 mttm 71.12 -67.69 0.24 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.824 0.345 . . . . 0.0 110.353 -179.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.723 ' HA ' ' O ' ' A' ' 20' ' ' TYR . 33.5 m95 -41.01 141.21 0.64 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.242 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.589 HD11 ' CE2' ' A' ' 22' ' ' PHE . 0.0 OUTLIER -138.34 125.95 28.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.277 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 20.4 t-20 -106.67 152.42 23.8 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.917 0.389 . . . . 0.0 111.457 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.4 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.6 m-85 -129.63 -128.14 0.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.943 -179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -49.92 -45.33 50.94 Favored 'General case' 0 C--O 1.231 0.085 0 CA-C-O 120.78 0.324 . . . . 0.0 111.066 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -0.74 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.483 179.822 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.435 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.71 158.77 20.49 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.358 0.599 . . . . 0.0 110.866 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.581 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 4.8 t -123.87 165.48 17.29 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.966 179.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.723 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.83 129.19 49.94 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.21 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -98.38 109.42 22.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.681 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -96.35 123.37 39.97 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.243 -178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -130.25 176.36 18.82 Favored Glycine 0 C--N 1.333 0.371 0 C-N-CA 120.75 -0.738 . . . . 0.0 113.031 -179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 13.0 pttp -131.79 155.57 47.52 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.854 0.359 . . . . 0.0 110.909 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 105.54 -125.34 8.22 Favored Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.907 179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.729 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 59.32 -164.77 0.2 Allowed 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.715 0.293 . . . . 0.0 111.043 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -129.36 -76.99 0.55 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.338 -179.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.2 mp0 -122.17 -170.4 2.06 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.165 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HA ' ' CD1' ' A' ' 65' ' ' TRP . 83.6 t90 -62.13 -49.86 74.2 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.925 -179.828 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.4 m -54.97 -31.24 24.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.73 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.729 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.3 OUTLIER -72.23 -32.88 67.11 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.711 179.66 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.7 52.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.878 0.37 . . . . 0.0 110.766 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.868 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -61.58 -39.0 89.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.082 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -72.39 -39.61 67.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.331 -179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.58 -38.82 84.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.459 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.1 m -77.33 -26.43 52.11 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.994 0.426 . . . . 0.0 110.562 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.441 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 9.9 t70 -75.28 -22.06 58.06 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.037 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 19.3 t70 -58.32 -39.65 79.99 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.604 -179.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 4.6 mtt -174.33 -28.31 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.683 -179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.56 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 20.5 mm-40 -44.8 -87.54 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.582 -179.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.27 -95.78 0.11 Allowed Glycine 0 C--N 1.33 0.234 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.515 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.489 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.2 tt0 -151.68 161.9 41.9 Favored 'General case' 0 CA--C 1.508 -0.673 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.868 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.3 tp -74.69 112.74 11.19 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 106.495 -1.669 . . . . 0.0 106.495 178.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.825 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -26.25 -71.73 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 113.76 -1.563 . . . . 0.0 114.212 -177.338 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.654 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.6 OUTLIER 66.12 51.32 1.3 Allowed 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.536 -178.104 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.893 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -39.48 140.39 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.964 -179.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -128.85 -3.88 5.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.852 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.434 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.8 m -117.67 122.47 30.72 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.213 179.732 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.451 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 81.7 Cg_exo -45.46 -30.13 5.53 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.25 1.967 . . . . 0.0 111.656 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.3 tt0 -73.41 -45.5 54.22 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.874 179.124 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 62.6 mt-10 -64.93 -43.36 93.0 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.634 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.632 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.86 -40.71 95.57 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.005 0.431 . . . . 0.0 109.892 179.456 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 21.4 t70 -68.37 -34.57 76.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.725 -0.671 . . . . 0.0 109.637 178.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.465 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.85 -51.83 68.02 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.472 -178.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.884 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.93 -33.77 62.01 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.248 179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.632 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.35 -42.05 94.91 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.466 179.75 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -34.84 62.85 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.495 -0.775 . . . . 0.0 108.934 178.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 10.8 t-80 -66.19 -31.88 72.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.102 179.16 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.4 96.2 0.08 Allowed 'General case' 0 C--O 1.231 0.096 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.103 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 40.4 p -96.82 50.36 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.948 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -153.89 -71.66 0.13 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.858 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.2 OUTLIER -146.64 -36.81 0.24 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.896 179.936 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . 169.04 -172.86 43.46 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.674 -0.774 . . . . 0.0 112.57 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.644 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.1 OUTLIER -123.09 162.78 21.79 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.568 0.223 . . . . 0.0 110.561 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.668 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.4 132.57 52.28 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.952 0.406 . . . . 0.0 110.801 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.893 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -111.6 166.67 5.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.756 -179.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.725 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -79.94 57.03 4.58 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.33 -0.85 . . . . 0.0 112.766 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.925 HD11 ' HB3' ' A' ' 77' ' ' PHE . 2.0 tm? -123.62 126.64 46.98 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.398 0.618 . . . . 0.0 112.175 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.588 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.6 121.02 15.04 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.035 -0.984 . . . . 0.0 109.231 177.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.404 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.7 t30 -93.92 138.05 32.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.969 0.414 . . . . 0.0 111.097 -179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 146.63 39.48 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.038 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 58.04 -93.69 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.076 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 102' ' ' GLU . 0.2 OUTLIER -167.45 -54.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.842 -179.866 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 pttt -101.23 7.64 42.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.071 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -71.13 -133.22 0.11 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.653 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -118.73 146.31 44.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.88 0.371 . . . . 0.0 110.735 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.925 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -79.61 122.15 26.15 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.589 -179.722 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.33 141.44 35.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.642 -179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.441 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.2 m0 -74.44 150.3 40.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.384 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.671 HG11 ' CB ' ' A' ' 43' ' ' LEU . 0.8 OUTLIER -59.27 -25.35 30.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.455 179.745 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -77.42 -4.8 47.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.638 179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 86.19 41.78 6.9 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.972 -0.633 . . . . 0.0 112.85 179.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.84 123.72 17.54 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.844 0.354 . . . . 0.0 111.248 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 9.2 p-80 -57.44 150.85 17.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.145 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 77' ' ' PHE . 19.0 t -58.02 158.81 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.26 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' N ' HG12 ' A' ' 85' ' ' VAL . 29.6 m-20 -128.18 -48.77 1.32 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.336 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 41.0 m-85 -103.67 -45.98 4.66 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.38 -179.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.515 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER 60.29 154.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.382 179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.719 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 83.9 m-20 -136.94 -15.26 1.54 Allowed 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 112.176 0.436 . . . . 0.0 112.176 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.626 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.1 OUTLIER -39.85 102.58 0.03 OUTLIER 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.11 0.481 . . . . 0.0 111.206 -179.216 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -49.25 120.71 10.34 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.447 -179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -86.58 -5.87 8.04 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.842 2.361 . . . . 0.0 112.421 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -82.47 11.27 52.08 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.863 -0.684 . . . . 0.0 112.596 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -129.39 72.24 81.98 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.742 0.306 . . . . 0.0 110.903 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_exo -57.3 116.24 3.07 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.622 2.214 . . . . 0.0 112.315 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.6 p -73.69 126.74 31.0 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.918 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -139.12 -29.66 0.76 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.869 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.77 -31.03 70.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.941 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.1 t -158.3 156.73 31.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.857 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -128.86 153.41 47.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.881 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.552 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 175.0 -77.74 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.513 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.457 ' H ' ' N ' ' A' ' 117' ' ' PHE . 22.4 mt-10 60.84 100.81 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.908 0.385 . . . . 0.0 111.158 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 117' ' ' PHE . 34.8 t70 -149.26 -27.34 0.28 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.623 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -140.79 145.22 36.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.275 179.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.709 HG23 HD12 ' A' ' 68' ' ' LEU . 53.3 t -106.79 135.81 43.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.172 0.511 . . . . 0.0 111.209 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.813 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.7 OUTLIER -129.56 169.79 14.56 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.881 -179.136 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.644 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -122.31 132.09 54.23 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.852 0.358 . . . . 0.0 110.518 179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.79 -174.88 2.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.05 -179.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -67.67 -10.55 58.33 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.672 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 58.8 m -59.44 -42.65 92.41 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.921 0.391 . . . . 0.0 110.765 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.604 ' HA2' HG21 ' A' ' 56' ' ' THR . . . 127.86 -8.72 6.81 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.787 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -127.15 -155.64 0.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.766 0.317 . . . . 0.0 111.336 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.719 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 22.8 m0 -107.55 162.62 13.78 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.594 0.711 . . . . 0.0 111.543 -179.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -138.47 119.61 14.56 Favored 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.368 -1.287 . . . . 0.0 107.604 175.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.626 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 28.5 t70 -81.52 124.98 29.94 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.532 -178.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.42 161.62 40.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.471 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.552 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 30.8 t80 -41.76 -80.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.582 -0.281 . . . . 0.0 110.81 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 174.95 31.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.811 179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -94.84 -15.68 23.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.579 179.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -63.12 122.55 16.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.702 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.3 102.39 14.12 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.937 -179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.813 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.4 mp -85.18 -153.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.587 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -157.72 12.69 0.26 Allowed Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.079 -1.057 . . . . 0.0 113.393 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -148.93 132.09 16.38 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 117.368 0.584 . . . . 0.0 111.601 179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.459 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 1.4 p-90 -104.96 116.25 31.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.743 179.117 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.606 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.5 t -111.92 134.5 54.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.939 -178.55 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.474 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.02 165.5 24.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.397 -179.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.41 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 0.8 OUTLIER -126.15 144.2 50.84 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.12 0.486 . . . . 0.0 110.381 179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.54 149.49 23.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.416 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.404 ' O ' HG23 ' A' ' 132' ' ' THR . 0.1 OUTLIER -66.64 133.07 49.5 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.75 179.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -47.88 118.04 2.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.548 -179.545 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.523 ' O ' ' HB ' ' A' ' 7' ' ' THR . 19.9 p -131.46 -160.04 1.01 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.987 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.453 ' H ' ' HB ' ' A' ' 132' ' ' THR . 1.9 t -126.24 107.74 10.63 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.79 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.71 114.59 27.83 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.029 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -74.0 140.56 28.62 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.543 2.162 . . . . 0.0 112.313 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.08 92.48 0.73 Allowed 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 122.505 2.137 . . . . 0.0 112.36 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.24 87.32 0.06 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.187 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.0 p -73.94 177.57 5.53 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.931 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 55.72 39.35 30.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.044 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . 174.52 14.16 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.484 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . 0.415 ' O ' ' HG2' ' A' ' 143' ' ' GLU . 0.7 OUTLIER -78.37 -171.69 2.53 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.847 0.356 . . . . 0.0 110.901 -179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.74 96.35 0.4 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.13 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 141' ' ' SER . 8.2 pt-20 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.902 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.787 0.327 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 173.17 -37.83 0.14 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.494 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -78.82 145.56 34.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.904 0.383 . . . . 0.0 110.853 -179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.3 t -104.56 -48.68 9.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.108 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.0 t -143.19 -101.36 0.12 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.971 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -176.5 50.52 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.902 0.382 . . . . 0.0 110.833 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.3 t -84.11 0.85 46.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.095 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.79 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.0 m -116.18 84.33 13.84 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.448 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.536 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 71.7 Cg_endo -80.12 -64.51 0.02 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.677 2.252 . . . . 0.0 112.712 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.465 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 17.3 tt0 -127.22 -80.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.125 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.544 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 0.5 OUTLIER -50.5 -40.81 52.24 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.843 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.79 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 13.2 m95 -73.49 139.77 45.97 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.56 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.561 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -132.06 125.91 55.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.162 -179.898 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.612 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.59 151.88 24.46 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.989 0.423 . . . . 0.0 111.258 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.8 m-85 -129.95 -128.74 0.21 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.956 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -50.21 -45.17 53.57 Favored 'General case' 0 C--N 1.334 -0.086 0 CA-C-O 120.776 0.322 . . . . 0.0 111.051 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.414 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -165.73 -1.31 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.46 179.783 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -113.55 158.01 21.31 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.548 0.69 . . . . 0.0 110.944 179.587 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.567 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.33 166.71 15.45 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.809 -1.087 . . . . 0.0 109.704 179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.74 139.87 53.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.104 0.478 . . . . 0.0 110.827 -179.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.571 ' CE2' ' HG3' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -98.13 109.85 22.53 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.123 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.665 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.1 m-30 -106.41 110.25 22.41 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -178.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -126.58 177.81 17.08 Favored Glycine 0 C--N 1.33 0.24 0 C-N-CA 120.84 -0.695 . . . . 0.0 113.249 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 17.3 pttm -129.48 155.65 45.39 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.799 0.333 . . . . 0.0 110.996 179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 108.77 -125.59 7.84 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.851 179.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.8 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.3 OUTLIER 59.9 -166.32 0.19 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.852 0.358 . . . . 0.0 111.169 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -126.3 -78.89 0.59 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.243 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -121.63 -171.09 2.16 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.044 -179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 80.7 t90 -61.89 -49.0 77.98 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.861 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.0 m -55.09 -31.41 25.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.723 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.8 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.1 OUTLIER -72.43 -32.77 66.6 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.649 179.657 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.431 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.95 -49.04 49.88 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.657 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.9 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -59.98 -39.12 84.63 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.815 179.558 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.76 -30.47 64.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.986 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -70.21 -40.96 74.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.518 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.897 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 1.7 m -80.49 -24.28 39.54 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.926 0.393 . . . . 0.0 110.446 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.426 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -75.4 -24.31 57.15 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.455 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.4 OUTLIER -57.98 -39.89 79.33 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.557 -179.258 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.452 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 1.4 mtt -179.12 -27.73 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.289 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.897 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -44.84 -89.4 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.439 -179.495 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.731 ' HA2' ' HD3' ' A' ' 129' ' ' ARG . . . -152.09 -99.66 0.19 Allowed Glycine 0 CA--C 1.518 0.255 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.532 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.519 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.4 tt0 -154.42 162.25 41.26 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -178.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.9 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.1 tp -74.51 112.95 11.19 Favored 'General case' 0 N--CA 1.435 -1.19 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.83 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -24.06 -71.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.526 -1.67 . . . . 0.0 114.277 -177.501 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.624 ' N ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 66.03 54.08 1.03 Allowed 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.0 109.596 -178.343 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.91 HD11 HG22 ' A' ' 66' ' ' ILE . 0.0 OUTLIER -43.74 142.84 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.822 -179.04 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -132.86 -1.78 3.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.772 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 28.7 t -121.8 122.79 27.66 Favored Pre-proline 0 N--CA 1.454 -0.274 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.183 179.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.544 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 80.6 Cg_exo -46.2 -28.51 5.65 Favored 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.334 2.023 . . . . 0.0 111.779 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.453 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 19.9 tt0 -73.44 -46.53 47.94 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.829 179.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 27.6 mt-10 -64.0 -43.57 95.25 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.486 -179.562 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.747 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -62.18 -42.63 99.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.039 0.447 . . . . 0.0 109.991 179.286 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -66.97 -35.47 80.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.655 179.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.453 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.41 -51.25 70.28 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.73 -179.039 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.874 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.27 -38.48 63.43 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.962 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.643 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -60.72 -39.21 87.74 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 -179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.93 -35.89 64.62 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.434 178.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.544 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 2.0 t-80 -69.1 -32.12 71.31 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.247 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.88 -1.84 15.76 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 57.65 -148.48 0.49 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.89 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -54.66 -31.99 58.47 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.113 -179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.602 HG21 ' HA3' ' A' ' 123' ' ' GLY . 0.0 OUTLIER -76.94 -169.4 1.3 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.905 179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.604 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -123.58 175.98 16.74 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.701 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.493 ' H ' ' HG3' ' A' ' 107' ' ' MET . 2.6 p -120.98 163.08 18.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.48 -0.193 . . . . 0.0 110.48 179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.624 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.5 m-90 -106.67 132.55 52.53 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.064 0.459 . . . . 0.0 110.611 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.91 HG22 HD11 ' A' ' 46' ' ' ILE . 1.1 pt -112.49 166.87 6.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.582 -179.02 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.69 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -76.33 55.29 3.23 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.843 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.799 HD12 HG23 ' A' ' 105' ' ' VAL . 1.8 tm? -122.93 127.75 49.34 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.47 0.652 . . . . 0.0 112.408 -179.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.597 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -138.51 120.78 15.86 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.818 -1.083 . . . . 0.0 109.166 177.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.534 ' ND2' ' HG3' ' A' ' 102' ' ' GLU . 13.9 t-20 -95.09 135.12 37.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.921 0.391 . . . . 0.0 111.057 -179.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.0 mt -98.94 157.7 16.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.076 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 58.07 20.06 6.56 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.178 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.824 ' HB3' ' HA3' ' A' ' 101' ' ' GLY . 3.6 mp 59.71 -85.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.059 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.0 mttm -77.37 7.55 5.19 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.017 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.21 -125.06 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -127.26 146.77 50.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 110.998 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.629 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -75.29 135.32 40.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.364 0.602 . . . . 0.0 111.421 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.39 141.22 45.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.357 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.555 ' HE1' HG22 ' A' ' 85' ' ' VAL . 40.9 m0 -74.19 150.42 40.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.911 0.386 . . . . 0.0 110.838 -179.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.686 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.31 -25.1 29.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.367 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -77.1 -1.42 29.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.571 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 82.3 42.26 8.73 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.991 -0.623 . . . . 0.0 112.865 179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.1 m -142.2 119.45 11.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.698 0.285 . . . . 0.0 111.275 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.6 p-80 -52.26 150.55 4.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.367 -0.378 . . . . 0.0 110.93 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.629 HG21 ' CD2' ' A' ' 77' ' ' PHE . 91.8 t -59.7 149.39 6.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.502 -179.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -115.05 -58.88 2.09 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.8 -179.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -94.38 -46.95 6.8 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 58.82 165.5 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 -178.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.747 HD21 ' HG2' ' A' ' 52' ' ' GLN . 52.2 m-20 -127.42 -31.89 2.48 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.343 -179.197 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.485 ' C ' ' O ' ' A' ' 89' ' ' ASN . 30.5 m0 22.01 83.07 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.478 0.486 . . . . 0.0 112.017 179.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.808 ' HB2' ' HB2' ' A' ' 112' ' ' ARG . . . -49.36 114.66 4.15 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.661 0.267 . . . . 0.0 111.296 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -58.06 109.92 0.56 Allowed 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.572 2.181 . . . . 0.0 112.285 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 149.47 -32.46 1.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.535 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -124.6 78.62 63.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 120.777 0.322 . . . . 0.0 110.908 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -71.3 -7.85 22.17 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.598 2.199 . . . . 0.0 112.419 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.645 HG21 ' HB2' ' A' ' 116' ' ' ALA . 11.2 p 51.07 34.83 11.59 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.097 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.1 p -80.7 154.91 27.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.875 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 56.59 29.26 15.27 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.995 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.0 m -132.9 -168.98 2.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.839 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -63.08 145.94 54.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.799 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.824 ' HA3' ' HB3' ' A' ' 73' ' ' LEU . . . -64.15 140.29 43.33 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.516 179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.55 ' HA ' ' N ' ' A' ' 117' ' ' PHE . 2.1 pm0 -66.43 148.89 51.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.895 0.379 . . . . 0.0 111.059 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -136.69 -26.35 1.08 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.863 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.83 154.33 38.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.52 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.799 HG23 HD12 ' A' ' 68' ' ' LEU . 55.2 t -109.57 128.25 65.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 121.173 0.511 . . . . 0.0 111.282 179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.58 ' HB2' HD21 ' A' ' 122' ' ' LEU . 19.1 ptm -118.74 169.46 9.82 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.412 -179.807 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.493 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.18 130.5 53.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.126 0.489 . . . . 0.0 110.74 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 179.63 -164.94 0.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.753 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.92 -58.94 5.02 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.545 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.543 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 51.6 m -155.14 -1.93 0.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.634 0.254 . . . . 0.0 111.141 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.629 ' O ' HG21 ' A' ' 56' ' ' THR . . . 121.99 8.94 7.05 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.634 -0.793 . . . . 0.0 112.329 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.808 ' HB2' ' HB2' ' A' ' 91' ' ' ALA . 1.3 mpt_? -104.8 -156.25 0.57 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.084 0.469 . . . . 0.0 111.162 -179.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.705 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.0 m0 -107.32 161.93 14.36 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 121.869 0.842 . . . . 0.0 112.111 -179.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.8 m-80 -139.48 120.46 14.55 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 114.211 -1.358 . . . . 0.0 107.586 175.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 105' ' ' VAL . 11.5 t0 -101.27 98.33 8.74 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.4 -179.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.645 ' HB2' HG21 ' A' ' 96' ' ' THR . . . -156.81 161.73 39.73 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.418 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.55 ' N ' ' HA ' ' A' ' 102' ' ' GLU . 25.4 t80 -45.42 156.85 0.1 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.073 179.669 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.403 ' SG ' ' HB3' ' A' ' 29' ' ' TRP . 0.8 OUTLIER -78.19 64.56 3.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.082 -179.9 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -109.15 -15.45 14.31 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.843 179.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -90.62 175.74 6.93 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.787 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 4.7 mmtp -138.68 117.75 12.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.074 -179.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.624 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.8 mp -86.49 -143.66 0.11 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.422 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.602 ' HA3' HG21 ' A' ' 62' ' ' THR . . . -166.02 14.83 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.152 -1.023 . . . . 0.0 113.51 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.635 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -149.04 133.83 17.9 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 117.154 0.477 . . . . 0.0 111.534 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.436 ' HB3' ' OG1' ' A' ' 26' ' ' THR . 13.4 p-90 -104.6 114.87 29.37 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.185 179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.624 HG12 ' CG2' ' A' ' 44' ' ' VAL . 3.7 t -112.14 135.95 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.478 -179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.427 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.2 m -138.87 167.56 21.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.763 -178.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -126.52 142.73 51.44 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 121.087 0.47 . . . . 0.0 110.143 179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.731 ' HD3' ' HA2' ' A' ' 41' ' ' GLY . 14.2 tpt180 -157.85 152.11 24.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.001 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.442 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.66 132.57 48.43 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.801 0.334 . . . . 0.0 110.756 179.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -58.84 95.01 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.63 -179.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 44.6 p -131.86 134.01 45.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.026 179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.36 152.01 30.66 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.82 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -141.34 107.79 6.15 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.965 180.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.518 ' N ' ' HD2' ' A' ' 136' ' ' PRO . 73.2 Cg_exo -48.23 -48.05 17.93 Favored 'Trans proline' 0 CA--C 1.535 0.537 0 C-N-CA 122.691 2.261 . . . . 0.0 113.204 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.518 ' HD2' ' N ' ' A' ' 135' ' ' PRO . 56.7 Cg_endo -69.98 89.51 0.55 Allowed 'Trans proline' 0 C--N 1.352 0.72 0 C-N-CA 122.037 1.824 . . . . 0.0 112.362 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -139.17 -36.2 0.54 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.112 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -90.2 143.7 26.53 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.903 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -68.52 119.05 12.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.95 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -66.58 133.34 32.56 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.421 -179.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 2.7 p -138.09 -55.64 0.65 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.791 0.329 . . . . 0.0 110.946 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.67 -68.51 0.56 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.184 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 . . . . . 0 C--O 1.25 1.117 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.839 180.0 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.826 0.346 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -78.56 -163.04 22.71 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.468 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -117.57 -50.72 2.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.838 0.351 . . . . 0.0 110.924 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 38.5 t -113.19 -52.49 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 98.9 m -135.72 -102.91 0.22 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.894 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.16 70.06 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.789 0.328 . . . . 0.0 110.79 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -94.98 8.72 41.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.997 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.814 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.2 m -117.29 79.64 11.6 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.429 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.544 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 70.0 Cg_endo -76.28 -68.79 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.66 2.24 . . . . 0.0 112.581 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -126.48 -77.74 0.58 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.148 -179.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 2.8 mttp -51.14 -41.1 59.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.854 -179.838 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.814 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.5 m95 -72.03 146.11 47.85 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.389 179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.543 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -136.63 126.09 38.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.578 -179.939 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.613 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.63 152.02 24.3 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.28 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -130.58 -128.91 0.2 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.997 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -50.3 -44.25 53.94 Favored 'General case' 0 C--O 1.23 0.078 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.059 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' A' ' 18' ' ' LYS . 1.5 ptt180 -166.38 -2.16 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.55 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.422 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.1 OUTLIER -113.55 158.26 21.0 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.474 0.654 . . . . 0.0 110.882 179.628 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.582 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.0 t -124.17 166.38 15.93 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.997 179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.667 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.06 134.61 53.36 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.047 -179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.4 t80 -98.2 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.678 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.2 m-30 -101.68 126.36 48.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.128 -178.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.94 -175.04 20.31 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.694 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -114.92 161.57 18.11 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.91 0.386 . . . . 0.0 110.995 -179.926 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 157.37 117.36 0.53 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.873 -0.68 . . . . 0.0 112.566 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.509 ' HA ' ' HA2' ' A' ' 123' ' ' GLY . 71.5 p -88.39 115.67 26.06 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.827 0.346 . . . . 0.0 110.953 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.572 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -168.91 -137.62 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.784 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.484 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 5.0 mt-30 -123.16 175.54 6.59 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.773 0.321 . . . . 0.0 110.982 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.53 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.7 t90 -63.03 -47.99 80.68 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.044 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 8.3 m -55.26 -31.13 26.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.915 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.3 -31.96 66.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.654 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.88 -48.78 51.91 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.749 179.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.892 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -61.1 -39.09 88.64 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.926 179.526 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -72.57 -33.48 66.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.119 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.48 -41.47 80.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.366 -179.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.782 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -76.98 -26.09 53.5 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.28 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -75.01 -21.98 58.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.008 179.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.31 -39.44 79.39 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.4 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 2.4 ptt? -178.82 -27.06 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.526 -179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.782 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 8.2 mt-10 -47.15 -91.37 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.53 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -150.88 -97.95 0.17 Allowed Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.165 -1.017 . . . . 0.0 113.449 -179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.7 tt0 -153.0 162.39 41.38 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 -178.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.892 HD22 ' HB3' ' A' ' 33' ' ' ARG . 7.9 tp -73.67 112.86 10.16 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 179.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.898 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -20.9 -71.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 113.344 -1.753 . . . . 0.0 114.274 -177.397 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.734 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 64.76 64.27 0.67 Allowed 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -178.371 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.762 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.59 139.66 17.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.884 -178.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.408 ' HB3' ' CH2' ' A' ' 79' ' ' TRP . 10.8 p80 -133.95 -1.35 3.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.763 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.516 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 10.0 m -119.93 123.26 28.53 Favored Pre-proline 0 N--CA 1.453 -0.308 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.18 179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.52 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 79.8 Cg_exo -45.92 -28.68 5.21 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.326 2.017 . . . . 0.0 111.788 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.483 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.1 tt0 -73.53 -47.05 43.92 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.88 179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.664 ' HB2' HG22 ' A' ' 46' ' ' ILE . 51.4 mt-10 -63.95 -43.22 96.48 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.586 -179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.649 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -64.28 -42.11 96.58 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 179.288 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.502 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 9.8 t70 -66.52 -34.95 79.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.769 178.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.483 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.31 -51.35 69.89 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.615 -179.044 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.762 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.48 -38.44 62.89 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.094 0.473 . . . . 0.0 110.361 179.097 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.661 HG21 ' O ' ' A' ' 111' ' ' GLY . 0.8 OUTLIER -60.08 -38.71 83.68 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.537 -179.94 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.502 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -75.47 -34.77 60.94 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 178.251 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.481 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 30.6 t-80 -66.13 -29.92 70.32 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.07 179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.546 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -58.35 125.32 22.8 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.144 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 2.4 p -110.96 97.61 6.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.91 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 1.1 m80 60.5 12.34 3.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.038 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.546 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 1.0 OUTLIER -154.05 119.6 5.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.771 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.646 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -58.69 178.16 1.75 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.92 -179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.494 ' H ' ' HG3' ' A' ' 107' ' ' MET . 0.0 OUTLIER -118.24 162.66 17.88 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.521 0.2 . . . . 0.0 110.486 179.816 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.648 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.7 m-90 -106.26 132.48 52.26 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 120.831 0.348 . . . . 0.0 110.541 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.898 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.4 pt -113.32 167.21 6.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.572 -179.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.734 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -73.98 53.94 2.17 Favored Glycine 0 N--CA 1.448 -0.556 0 CA-C-N 115.307 -0.861 . . . . 0.0 113.199 -179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.738 HD12 HG23 ' A' ' 105' ' ' VAL . 2.0 tm? -121.08 126.66 50.39 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.391 0.615 . . . . 0.0 112.141 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.534 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.45 121.37 15.56 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.491 178.11 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -84.11 153.5 23.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.855 0.359 . . . . 0.0 110.806 -179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -50.36 -81.02 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.892 -0.595 . . . . 0.0 111.285 -179.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.47 ' HB3' HD23 ' A' ' 73' ' ' LEU . 54.2 m-20 -125.05 -76.27 0.59 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.967 -179.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.535 ' HA ' ' O ' ' A' ' 101' ' ' GLY . 0.2 OUTLIER -150.33 -47.04 0.13 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.939 179.951 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.34 7.24 42.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.827 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -81.06 -143.8 3.82 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.525 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -127.5 151.05 49.35 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.957 0.408 . . . . 0.0 110.869 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.594 ' CD2' HG21 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -71.24 131.75 43.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.322 0.582 . . . . 0.0 111.371 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -130.21 141.4 46.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.398 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.575 ' HE1' HG22 ' A' ' 85' ' ' VAL . 44.4 m0 -74.04 150.9 40.38 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.909 0.385 . . . . 0.0 110.829 -179.52 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.798 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -59.35 -25.16 29.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.419 179.679 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.17 -4.31 43.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.649 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 85.79 41.62 7.14 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.932 -0.651 . . . . 0.0 112.916 179.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.24 119.88 13.29 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.746 0.308 . . . . 0.0 111.296 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -54.48 148.22 12.51 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.863 179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.594 HG21 ' CD2' ' A' ' 77' ' ' PHE . 58.1 t -61.09 151.77 6.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.482 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -116.61 -63.22 1.48 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.583 -179.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -85.8 -55.41 3.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.985 -179.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.427 ' HB3' ' HE2' ' A' ' 77' ' ' PHE . 0.0 OUTLIER 61.06 149.31 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.542 -178.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.599 HD21 ' HG2' ' A' ' 52' ' ' GLN . 1.0 OUTLIER -105.38 -36.78 7.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.483 -179.099 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.417 ' C ' ' O ' ' A' ' 89' ' ' ASN . 23.9 m0 27.44 95.26 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.508 0.559 . . . . 0.0 112.508 178.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.39 129.9 61.47 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.598 -0.274 . . . . 0.0 111.003 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -78.88 -12.87 14.59 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.614 2.209 . . . . 0.0 112.402 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -83.91 6.42 74.76 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.517 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -154.39 91.61 3.06 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 120.656 0.265 . . . . 0.0 110.878 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.1 106.64 2.2 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.55 2.166 . . . . 0.0 112.321 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 p 53.0 -163.05 0.09 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.121 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.21 111.68 2.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.0 -166.54 0.13 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.035 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.3 m -80.27 -40.58 26.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.893 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -116.14 176.74 4.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.886 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 73' ' ' LEU . . . 136.52 -144.99 16.84 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.444 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.498 ' H ' ' N ' ' A' ' 117' ' ' PHE . 3.5 tt0 62.98 120.77 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.899 0.38 . . . . 0.0 111.424 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.443 ' O ' ' HA ' ' A' ' 69' ' ' ARG . 0.9 OUTLIER -175.18 -36.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.765 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 26.8 p -141.28 143.99 34.4 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.124 0.487 . . . . 0.0 110.704 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.738 HG23 HD12 ' A' ' 68' ' ' LEU . 43.1 t -107.45 132.58 54.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.028 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.941 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.5 OUTLIER -127.89 169.68 13.67 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.47 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.581 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.0 OUTLIER -121.22 143.47 49.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.102 0.477 . . . . 0.0 110.543 179.534 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 175.13 -174.59 0.08 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 82.74 -100.17 2.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.819 -0.705 . . . . 0.0 112.8 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.2 m -100.75 -15.72 17.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.725 0.298 . . . . 0.0 111.178 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.661 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.81 19.22 1.84 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.245 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 112' ' ' ARG . 0.0 OUTLIER -112.27 -157.15 0.61 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.795 0.331 . . . . 0.0 111.058 -179.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.645 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 40.0 m0 -107.59 162.14 14.23 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-O 121.702 0.763 . . . . 0.0 111.832 -179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -138.62 120.1 14.96 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.162 -1.381 . . . . 0.0 107.458 175.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -96.81 113.14 24.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.504 -179.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.19 162.04 40.23 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.112 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.498 ' N ' ' H ' ' A' ' 102' ' ' GLU . 34.3 t80 -37.68 -78.27 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 173.07 32.26 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.72 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -79.01 -20.7 48.37 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.796 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.31 126.69 31.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.823 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.53 103.56 15.52 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.973 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.941 HD21 ' HB2' ' A' ' 106' ' ' MET . 5.2 mp -85.3 -163.95 0.92 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.848 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.509 ' HA2' ' HA ' ' A' ' 26' ' ' THR . . . -165.5 30.56 0.22 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.46 -0.876 . . . . 0.0 112.913 -179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.559 ' HB3' ' O ' ' A' ' 63' ' ' GLY . . . -141.75 131.42 24.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.034 0.445 . . . . 0.0 111.554 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 37.8 m0 -99.63 104.51 16.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.73 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.641 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -112.94 129.79 67.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 121.141 0.496 . . . . 0.0 110.117 179.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.0 m -137.5 166.95 22.65 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 -178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.21 143.59 51.08 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.08 0.466 . . . . 0.0 110.173 179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.33 152.41 25.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.422 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.29 134.88 49.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.672 179.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.11 98.88 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.769 -179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 11.8 p -131.68 129.36 40.66 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.989 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.24 97.16 0.9 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.814 179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 15.1 p -135.24 149.48 70.05 Favored Pre-proline 0 C--N 1.331 -0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.817 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.49 138.62 46.55 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.575 2.184 . . . . 0.0 112.331 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -73.03 97.77 0.95 Allowed 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.585 2.19 . . . . 0.0 112.357 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 55.88 83.53 0.09 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.167 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.4 t -101.97 129.15 48.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.858 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -68.14 133.47 48.98 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.877 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -69.21 112.48 4.56 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.455 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 57.27 23.82 9.21 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.781 0.324 . . . . 0.0 111.043 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 55.07 81.69 0.11 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.179 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.912 179.996 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.778 0.323 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -81.8 -27.57 45.83 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.785 -0.721 . . . . 0.0 112.494 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -90.25 130.41 36.38 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.762 0.315 . . . . 0.0 110.947 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.454 HG21 ' HB3' ' A' ' 131' ' ' ALA . 30.8 m -108.05 -160.81 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.126 179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -67.33 -171.02 0.15 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.931 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -126.15 53.84 1.59 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.865 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.541 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 6.4 t -90.23 6.91 40.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.096 -179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.813 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -118.25 80.46 15.77 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.408 -179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.541 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 87.9 Cg_endo -84.58 -63.67 0.02 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.515 0 C-N-CA 122.852 2.368 . . . . 0.0 112.772 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.424 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.2 tp10 -123.44 -84.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.205 -179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 22' ' ' PHE . 3.0 mttt -50.5 -42.86 55.39 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.861 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.813 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 20.2 m95 -70.74 139.42 51.09 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.403 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.557 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -133.05 125.97 52.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.318 -179.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.9 t-20 -106.49 152.16 24.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.409 -179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HE2' ' CD1' ' A' ' 20' ' ' TYR . 5.0 m-85 -130.55 -128.87 0.2 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.017 -179.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -49.94 -45.02 50.81 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.003 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.416 ' H ' ' H ' ' A' ' 18' ' ' LYS . 4.3 ptt180 -165.78 -2.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.445 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.416 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.52 158.01 21.29 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-O 121.598 0.713 . . . . 0.0 110.96 179.672 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 131' ' ' ALA . 8.4 t -124.16 166.51 15.69 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.87 179.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.709 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -123.87 132.85 53.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.046 -179.639 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -97.66 109.4 22.17 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 179.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.668 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -98.39 122.43 41.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.236 -178.208 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -129.53 173.66 19.57 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.877 -0.678 . . . . 0.0 113.092 -179.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.595 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 21.5 tttt -139.1 153.06 47.96 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.916 0.389 . . . . 0.0 110.863 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.545 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 81.29 97.55 0.41 Allowed Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.684 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.28 -157.81 0.74 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 110.829 179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -114.85 -91.34 0.52 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.291 -179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -123.51 -170.91 2.21 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.189 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.475 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.3 t90 -60.33 -48.95 79.56 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.891 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.13 -31.38 25.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.786 179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -72.4 -32.29 66.24 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.559 179.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' O ' ' SG ' ' A' ' 36' ' ' CYS . . . -70.88 -48.98 50.82 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.416 -0.357 . . . . 0.0 110.745 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.873 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -60.36 -37.95 82.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.956 179.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.43 -34.97 68.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.06 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -69.07 -40.09 78.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.457 -179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.716 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 4.1 m -76.01 -27.15 57.26 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.018 0.437 . . . . 0.0 110.399 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.502 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -74.9 -22.78 58.43 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.0 179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -58.25 -39.65 79.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.437 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.8 ptt? -179.44 -26.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.604 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.716 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 35.1 mm-40 -46.54 -89.13 0.0 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.449 -0.342 . . . . 0.0 111.418 -179.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -154.59 -96.37 0.13 Allowed Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.225 -0.988 . . . . 0.0 113.443 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.513 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.0 tt0 -153.98 162.32 41.3 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.266 -1.012 . . . . 0.0 108.266 -178.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.873 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.12 112.82 10.63 Favored 'General case' 0 N--CA 1.434 -1.262 0 C-N-CA 117.686 -1.606 . . . . 0.0 106.668 179.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.88 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.13 -71.81 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 113.472 -1.694 . . . . 0.0 114.27 -177.287 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.736 ' N ' ' H ' ' A' ' 67' ' ' GLY . 48.0 t 67.14 47.86 1.29 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.361 0.601 . . . . 0.0 109.544 -178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.742 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -40.17 140.59 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 114.948 -1.024 . . . . 0.0 112.052 -179.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 18.9 p80 -133.52 -2.45 3.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.985 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.551 ' HB2' ' HG3' ' A' ' 51' ' ' GLU . 4.3 m -118.66 123.86 28.84 Favored Pre-proline 0 N--CA 1.454 -0.264 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.298 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.53 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 82.0 Cg_exo -46.31 -28.42 5.78 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 122.298 1.999 . . . . 0.0 111.763 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 20.9 tt0 -73.53 -47.02 44.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.832 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.727 ' HB2' HG22 ' A' ' 46' ' ' ILE . 46.7 mt-10 -64.63 -42.93 95.14 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.575 -179.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.768 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.88 -42.59 97.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.138 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 11.2 t70 -66.55 -34.83 78.77 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.783 178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.475 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.3 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.507 -179.002 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.742 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.45 -36.76 63.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.214 0.53 . . . . 0.0 110.124 178.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.9 OUTLIER -60.16 -38.69 83.96 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.58 179.918 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.4 OUTLIER -76.09 -34.55 59.52 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.164 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.478 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 26.8 t-80 -65.48 -30.29 71.05 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.167 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.04 102.63 0.3 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.082 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.4 m -99.14 -29.75 12.68 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -76.75 -62.16 1.73 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.888 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 122' ' ' LEU . 0.0 OUTLIER -151.37 -63.13 0.18 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.947 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.642 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -165.67 179.58 39.91 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.556 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.459 ' OG ' HD13 ' A' ' 55' ' ' LEU . 4.3 p -115.44 162.34 17.3 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.548 0.213 . . . . 0.0 110.581 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.62 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -106.93 132.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 120.937 0.399 . . . . 0.0 110.433 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.88 ' HA ' HG23 ' A' ' 44' ' ' VAL . 0.6 OUTLIER -110.73 165.83 5.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.756 -179.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.736 ' H ' ' N ' ' A' ' 45' ' ' SER . . . -77.51 54.61 3.67 Favored Glycine 0 N--CA 1.447 -0.592 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.694 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.962 HD13 HG21 ' A' ' 105' ' ' VAL . 0.5 OUTLIER -126.96 126.64 43.56 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.251 0.548 . . . . 0.0 112.032 179.939 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.475 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.25 121.78 16.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.168 178.588 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.551 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -84.56 154.15 22.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.756 0.312 . . . . 0.0 110.732 179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.453 ' HB3' ' HD3' ' A' ' 74' ' ' LYS . 0.4 OUTLIER -69.52 85.15 0.43 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.04 -179.62 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' ' 73' ' ' LEU . 0.7 OUTLIER 58.71 -88.3 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.98 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.456 ' H ' ' HB3' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -158.85 31.19 0.22 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.765 -179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.453 ' HD3' ' HB3' ' A' ' 71' ' ' LEU . 1.6 mtpp -75.93 -18.31 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.031 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 100.51 15.38 29.84 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.744 179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -126.79 124.44 39.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.834 0.35 . . . . 0.0 110.705 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.792 ' HB2' HD21 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -93.49 145.49 24.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.431 0.634 . . . . 0.0 112.371 -179.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -143.33 141.02 26.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.379 179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.547 ' HD1' ' HG ' ' A' ' 68' ' ' LEU . 48.1 m0 -74.87 151.25 38.98 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.006 0.432 . . . . 0.0 111.592 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.741 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.3 p -59.31 -25.76 31.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 CA-C-N 115.657 -0.702 . . . . 0.0 110.669 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.09 4.71 9.6 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.441 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 75.08 42.63 28.78 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.741 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -142.22 117.26 10.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.718 0.294 . . . . 0.0 111.149 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -48.07 140.09 7.46 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.955 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.533 HG22 ' CD1' ' A' ' 79' ' ' TRP . 31.3 t -56.8 152.54 2.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.194 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -116.98 -78.0 0.57 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.894 -179.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 36.5 m-85 -74.25 -48.23 30.1 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -178.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.471 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 54.53 174.37 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.834 0.349 . . . . 0.0 110.394 -178.886 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.768 HD21 ' HG2' ' A' ' 52' ' ' GLN . 6.3 m-20 -132.99 -19.15 2.28 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -179.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.535 ' C ' ' O ' ' A' ' 89' ' ' ASN . 29.7 m0 5.3 101.95 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.796 0 O-C-N 123.821 0.7 . . . . 0.0 112.52 179.346 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.53 135.5 62.82 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.182 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -72.1 -31.91 11.53 Favored 'Trans proline' 0 C--N 1.345 0.389 0 C-N-CA 122.482 2.122 . . . . 0.0 112.332 -179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -127.48 86.7 0.33 Allowed Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.478 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -156.43 97.47 2.18 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 120.691 0.281 . . . . 0.0 110.87 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -68.19 107.83 1.63 Allowed 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.565 2.177 . . . . 0.0 112.345 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -75.6 138.66 41.58 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.924 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 55.9 m -91.04 156.01 18.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.863 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ttp180 -111.39 130.74 55.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.881 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . 0.43 ' HB2' ' OD2' ' A' ' 119' ' ' ASP . 0.4 OUTLIER -159.17 -49.23 0.06 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.892 -179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 17.6 mm100 -123.58 176.49 6.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.883 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -114.6 42.27 1.97 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.548 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.2 OUTLIER -79.67 -161.15 0.31 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.717 0.294 . . . . 0.0 110.845 179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.445 ' HB3' ' ND2' ' A' ' 70' ' ' ASN . 0.4 OUTLIER -166.46 97.39 0.58 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.005 -179.876 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.404 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -156.45 150.74 25.39 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-O 121.177 0.513 . . . . 0.0 111.321 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.962 HG21 HD13 ' A' ' 68' ' ' LEU . 53.7 t -108.27 134.33 50.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.908 179.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.763 ' HB2' HD21 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -129.39 167.29 18.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.274 179.968 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.74 ' HE2' ' N ' ' A' ' 108' ' ' ARG . 0.0 OUTLIER -122.65 136.12 54.79 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.137 0.494 . . . . 0.0 110.333 179.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.74 ' N ' ' HE2' ' A' ' 107' ' ' MET . 0.5 OUTLIER 178.08 174.26 0.57 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.722 -179.806 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 95.76 -93.63 1.59 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.799 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' A' ' 112' ' ' ARG . 66.3 m -104.01 -19.78 14.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.754 0.311 . . . . 0.0 111.17 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.548 ' HA2' ' HE1' ' A' ' 107' ' ' MET . . . 129.99 20.44 1.32 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.469 -179.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.606 ' HD3' ' HB2' ' A' ' 110' ' ' SER . 0.0 OUTLIER -117.13 -159.61 0.74 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.89 0.376 . . . . 0.0 111.021 -179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.642 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 38.8 m0 -107.08 163.12 13.26 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.622 0.725 . . . . 0.0 111.621 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -139.95 119.88 13.52 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.25 -1.341 . . . . 0.0 107.676 175.525 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.537 ' HA ' HG22 ' A' ' 105' ' ' VAL . 9.8 t0 -96.66 109.51 22.13 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.393 -179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.442 ' O ' ' C ' ' A' ' 117' ' ' PHE . . . -156.57 162.15 39.92 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.957 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.442 ' C ' ' O ' ' A' ' 116' ' ' ALA . 14.0 m-85 -33.45 -76.85 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.885 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.691 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.0 OUTLIER 166.86 40.89 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.627 178.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.43 ' OD2' ' HB2' ' A' ' 99' ' ' SER . 2.3 m-20 -72.14 -60.33 2.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.932 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.489 ' HB3' ' SD ' ' A' ' 106' ' ' MET . 4.8 tpt180 -57.99 149.28 23.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.927 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 8.6 mtpt -119.63 127.95 53.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.981 -179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.763 HD21 ' HB2' ' A' ' 106' ' ' MET . 4.5 mp -90.47 -156.61 0.44 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.78 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -159.42 19.25 0.26 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.117 -179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.595 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.54 133.97 20.79 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.966 0.383 . . . . 0.0 111.382 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -106.4 116.9 32.73 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.202 0.525 . . . . 0.0 110.19 179.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.595 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.1 t -112.53 139.83 35.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.473 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.943 -178.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.433 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.7 m -138.86 165.22 27.62 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.613 -179.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -126.69 143.26 51.29 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.229 0.538 . . . . 0.0 110.518 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.71 171.26 20.64 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.562 179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.434 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -81.24 132.56 35.35 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.747 -0.381 . . . . 0.0 110.415 179.334 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.614 ' HB2' ' HB2' ' A' ' 19' ' ' CYS . . . -66.57 81.87 0.1 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.627 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 81.1 p -132.0 22.38 4.54 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.998 179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.541 ' HA ' ' HB ' ' A' ' 7' ' ' THR . 62.9 m 59.52 -174.07 0.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.021 -179.925 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.55 89.97 5.69 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.936 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.34 113.47 3.48 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.519 2.146 . . . . 0.0 112.312 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.15 106.97 0.2 Allowed 'Trans proline' 0 C--N 1.346 0.432 0 C-N-CA 122.624 2.216 . . . . 0.0 112.268 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -68.41 97.02 0.72 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.07 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.6 p -81.51 168.85 17.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.91 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 55.15 61.89 2.73 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.017 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.68 113.48 4.83 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.789 -0.719 . . . . 0.0 112.438 -179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 80.4 p -72.18 144.78 48.42 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.79 0.329 . . . . 0.0 110.849 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -88.69 83.18 6.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.099 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.835 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.73 0.3 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.88 -153.06 24.98 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -80.92 155.21 26.61 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.813 0.34 . . . . 0.0 110.92 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' H ' ' A' ' 4' ' ' VAL . 6.4 m -73.15 -174.64 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.105 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.7 m 55.38 76.64 0.26 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.878 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -165.58 43.24 0.07 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.105 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t -90.47 1.8 56.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.876 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.693 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 3.5 m -112.93 84.93 7.27 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.618 -179.395 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.527 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 62.8 Cg_endo -75.07 -75.3 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 122.553 2.169 . . . . 0.0 112.611 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.48 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -120.42 -80.55 0.62 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.38 -179.702 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.725 ' HB2' ' HB2' ' A' ' 22' ' ' PHE . 0.4 OUTLIER -49.7 -37.92 30.96 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.073 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.693 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 23.1 m95 -67.94 145.04 54.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.71 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -138.45 125.88 27.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.096 179.712 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.627 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 0.4 OUTLIER -110.03 151.6 26.98 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.845 0.355 . . . . 0.0 111.3 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.496 ' N ' HD22 ' A' ' 14' ' ' ASN . 6.0 m-85 -127.26 -127.89 0.23 Allowed 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.965 -179.144 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.42 -44.74 45.54 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.005 179.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 6.9 ptt85 -167.23 -0.11 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.628 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' ASN . 0.1 OUTLIER -113.68 158.35 20.99 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.259 0.552 . . . . 0.0 110.499 179.347 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.606 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 8.3 t -125.64 166.2 17.17 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 115.186 -0.916 . . . . 0.0 110.224 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.679 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.1 m-30 -124.3 132.1 53.55 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.092 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -98.48 109.74 22.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.725 ' HB2' ' HB2' ' A' ' 11' ' ' LYS . 11.2 m-30 -97.15 122.68 40.43 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.778 -178.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -135.03 176.89 19.73 Favored Glycine 0 C--N 1.333 0.416 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.532 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 29.4 mttm -130.89 162.76 28.93 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.756 0.312 . . . . 0.0 110.869 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.0 -126.8 9.01 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.596 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.839 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 56.81 -165.51 0.14 Allowed 'General case' 0 C--N 1.333 -0.15 0 CA-C-O 120.821 0.343 . . . . 0.0 111.233 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 31.9 mttt -124.48 -82.58 0.64 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.123 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.43 ' HG2' ' HG2' ' A' ' 120' ' ' ARG . 31.6 mt-30 -119.01 -165.8 1.18 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.974 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.574 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 78.2 t90 -62.71 -49.98 72.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.043 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.498 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 9.0 m -54.95 -31.27 24.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.443 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.816 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.839 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.26 -31.74 66.05 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.621 179.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -71.01 -48.72 51.52 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.88 0.372 . . . . 0.0 110.882 179.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.846 ' HB3' HD22 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -62.3 -39.02 91.6 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.153 179.682 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.45 -39.47 67.79 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.358 -179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.91 -38.58 83.12 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.499 -179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.568 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 31.6 m -77.87 -26.13 49.04 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.907 0.384 . . . . 0.0 110.485 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.422 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.21 -22.45 57.94 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.051 179.688 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.09 -39.79 79.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.534 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.98 -29.16 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.709 -179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.568 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 24.2 mm-40 -46.51 -89.94 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.608 -179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.424 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -157.14 -97.24 0.13 Allowed Glycine 0 C--N 1.332 0.314 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.466 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.673 ' HG3' ' N ' ' A' ' 43' ' ' LEU . 24.8 tp60 -151.77 162.36 41.15 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -178.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.846 HD22 ' HB3' ' A' ' 33' ' ' ARG . 6.1 tp -73.58 113.0 10.2 Favored 'General case' 0 N--CA 1.435 -1.185 0 N-CA-C 106.708 -1.59 . . . . 0.0 106.708 179.041 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.826 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.15 -69.09 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 113.375 -1.738 . . . . 0.0 114.326 -177.443 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.628 ' H ' ' H ' ' A' ' 67' ' ' GLY . 0.2 OUTLIER 62.73 52.41 2.79 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -178.119 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.917 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -44.95 134.43 1.7 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 114.915 -1.039 . . . . 0.0 111.799 -178.65 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . 0.662 ' HB3' ' HH2' ' A' ' 79' ' ' TRP . 16.1 p80 -125.7 -4.28 7.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.84 -179.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -115.3 121.53 34.68 Favored Pre-proline 0 N--CA 1.452 -0.333 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.186 179.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' ASP . 89.2 Cg_exo -44.94 -29.8 4.01 Favored 'Trans proline' 0 N--CA 1.461 -0.404 0 C-N-CA 122.276 1.984 . . . . 0.0 111.678 -179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 21.9 tt0 -73.3 -46.58 48.78 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.019 179.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.596 ' HB2' HG22 ' A' ' 46' ' ' ILE . 58.6 mt-10 -64.94 -42.94 94.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.648 -179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.675 ' O ' ' HB ' ' A' ' 56' ' ' THR . 0.0 OUTLIER -65.86 -40.58 91.83 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.353 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.537 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 22.1 t0 -67.93 -34.4 76.52 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.637 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.474 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.05 -51.53 69.25 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.542 -178.994 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.917 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.58 -38.16 62.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.14 0.495 . . . . 0.0 110.451 179.156 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.675 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.7 OUTLIER -60.34 -38.89 85.21 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.518 -179.996 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -75.55 -34.98 60.77 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 11' ' ' LYS . 6.6 t60 -64.5 -32.06 73.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.292 -0.867 . . . . 0.0 109.735 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.491 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -73.23 98.22 2.59 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.887 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 m -61.81 -83.17 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.999 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -112.6 6.57 18.44 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.805 179.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.491 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 20.6 p -132.01 110.61 10.86 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.83 -179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.67 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -55.29 172.32 1.27 Allowed Glycine 0 C--N 1.331 0.284 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.824 -179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.493 ' O ' HD22 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -111.15 159.66 17.64 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.558 0.218 . . . . 0.0 110.621 179.844 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.717 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.8 m-90 -104.62 132.24 51.09 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.6 179.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.859 HG22 HD11 ' A' ' 46' ' ' ILE . 1.2 pt -112.14 167.21 5.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.775 -179.268 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.634 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.31 53.66 2.72 Favored Glycine 0 N--CA 1.447 -0.593 0 CA-C-N 115.252 -0.885 . . . . 0.0 113.784 -178.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.771 HD21 HG22 ' A' ' 85' ' ' VAL . 7.1 mt -124.5 126.76 46.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.241 0.543 . . . . 0.0 111.985 179.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.574 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 0.0 OUTLIER -139.04 126.82 22.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.26 178.963 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.553 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.1 OUTLIER -85.18 161.99 19.39 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.896 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.439 ' O ' ' HB2' ' A' ' 72' ' ' ASP . 10.4 mt -84.01 88.26 7.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.274 179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.439 ' HB2' ' O ' ' A' ' 71' ' ' LEU . 0.7 OUTLIER 67.82 -81.06 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.889 -179.538 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -173.31 39.46 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.671 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.7 mmmt -84.91 -18.35 34.96 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.239 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 104.59 4.75 42.9 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.633 -0.794 . . . . 0.0 112.844 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -114.28 125.1 53.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 179.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.693 ' HB3' HD22 ' A' ' 68' ' ' LEU . 3.2 m-85 -99.58 151.29 21.33 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.553 0.692 . . . . 0.0 111.91 -179.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -138.84 142.84 33.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 114.713 -1.131 . . . . 0.0 110.174 -179.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.662 ' HH2' ' HB3' ' A' ' 47' ' ' HIS . 28.6 m0 -72.77 144.82 47.43 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 -179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.704 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.6 OUTLIER -58.99 -22.69 22.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.395 179.805 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -76.72 -0.36 23.41 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.601 179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 83.2 41.57 8.47 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.941 -0.647 . . . . 0.0 113.013 179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.9 m -145.79 120.73 10.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.634 0.254 . . . . 0.0 111.248 179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -47.59 156.24 0.31 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.771 HG22 HD21 ' A' ' 68' ' ' LEU . 2.6 t -61.11 154.31 4.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.299 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 -123.71 -82.01 0.64 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.21 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -76.17 -44.03 39.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.241 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.64 ' HB3' HG11 ' A' ' 85' ' ' VAL . 0.3 OUTLIER 52.71 176.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.235 -179.71 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.755 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 70.8 m-20 -146.84 -11.07 0.45 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.194 -179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.479 ' HB3' ' HB2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -34.1 93.89 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.779 0.323 . . . . 0.0 111.115 -179.771 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.463 ' N ' ' O ' ' A' ' 89' ' ' ASN . . . 64.13 146.01 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.325 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -68.96 -23.48 34.47 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.589 2.193 . . . . 0.0 112.278 -179.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 159.58 18.48 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.53 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.99 87.57 23.03 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 120.697 0.284 . . . . 0.0 110.857 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -70.73 118.62 5.79 Favored 'Trans proline' 0 C--N 1.345 0.351 0 C-N-CA 122.468 2.112 . . . . 0.0 112.341 179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.3 141.76 57.08 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.0 t -65.4 -45.26 84.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.901 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -97.19 133.07 42.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.913 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 42.4 m -109.26 131.34 55.15 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.851 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -86.61 3.09 45.92 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.859 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . 0.724 ' HA3' ' HB2' ' A' ' 117' ' ' PHE . . . 128.96 -173.05 19.49 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.476 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.621 ' HB2' ' HE1' ' A' ' 77' ' ' PHE . 0.0 OUTLIER -162.57 121.33 2.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.723 0.297 . . . . 0.0 110.854 -179.935 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.525 ' HA ' ' OD1' ' A' ' 70' ' ' ASN . 7.9 t70 -167.51 -25.49 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.217 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.428 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -153.88 147.97 25.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.063 -179.99 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.638 HG21 HD13 ' A' ' 68' ' ' LEU . 22.4 t -101.68 142.7 15.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.593 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.789 ' HB2' HD21 ' A' ' 122' ' ' LEU . 1.7 ptt? -136.75 168.71 19.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.843 -179.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.536 ' SD ' ' HA2' ' A' ' 63' ' ' GLY . 0.6 OUTLIER -121.9 145.51 48.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.966 0.412 . . . . 0.0 109.96 179.153 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.444 ' HB3' ' H ' ' A' ' 109' ' ' GLY . 0.0 OUTLIER -155.46 -98.42 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.542 -179.466 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 108' ' ' ARG . . . -86.05 174.93 48.0 Favored Glycine 0 C--N 1.332 0.311 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.919 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.483 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 15.3 m 59.89 10.72 2.24 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-O 120.739 0.305 . . . . 0.0 111.246 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 53.98 42.2 70.07 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.555 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.505 ' HD2' ' O ' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -148.88 -156.24 0.7 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.814 0.34 . . . . 0.0 111.003 -179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.755 ' CD2' ' HB2' ' A' ' 89' ' ' ASN . 21.2 m0 -108.14 163.45 13.16 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-O 121.725 0.774 . . . . 0.0 111.722 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.9 m-20 -138.38 119.88 14.96 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.262 -1.336 . . . . 0.0 107.928 175.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.479 ' HB2' ' HB3' ' A' ' 90' ' ' TRP . 12.2 t70 -76.03 120.91 21.99 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.741 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.428 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -154.44 162.14 41.32 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.174 -179.587 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.724 ' HB2' ' HA3' ' A' ' 101' ' ' GLY . 34.5 t80 -47.84 -90.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.121 -179.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 170.63 50.62 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.827 0.346 . . . . 0.0 110.528 179.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.76 21.06 0.42 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.508 -179.577 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.43 ' HG2' ' HG2' ' A' ' 28' ' ' GLN . 0.0 OUTLIER 55.6 97.66 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.853 0.358 . . . . 0.0 111.103 179.774 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -130.26 -9.32 4.23 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.365 -179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.789 HD21 ' HB2' ' A' ' 106' ' ' MET . 2.0 mp -97.86 -172.92 2.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.984 0.421 . . . . 0.0 111.522 -179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -160.75 9.82 0.13 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.629 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -131.56 135.84 47.34 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.691 0.245 . . . . 0.0 110.663 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.48 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.2 p-90 -106.53 118.66 37.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.29 0.567 . . . . 0.0 110.925 -179.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.588 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.6 t -112.4 135.01 53.1 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.541 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.476 -179.517 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -134.83 165.64 24.83 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.517 -178.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.424 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.5 p-10 -125.88 143.87 50.9 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 121.176 0.512 . . . . 0.0 110.3 179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.418 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 9.0 tpt180 -157.06 150.06 23.74 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.249 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.65 143.04 56.19 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.726 0.298 . . . . 0.0 110.747 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -46.43 157.63 0.13 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.772 -179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 85.1 m -94.36 91.64 6.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.867 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -131.77 -174.09 3.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.898 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 2.9 m -130.74 96.6 22.86 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.847 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.41 ' HA ' ' HD2' ' A' ' 136' ' ' PRO . 50.4 Cg_exo -53.76 111.69 0.76 Allowed 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 122.594 2.196 . . . . 0.0 112.384 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 135' ' ' PRO . 53.2 Cg_endo -69.29 97.26 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.593 2.195 . . . . 0.0 112.268 179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 56.98 -165.99 0.14 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.256 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -153.44 -16.45 0.14 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.904 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 59.58 -89.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.034 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -65.15 124.48 28.04 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.479 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -66.52 146.21 54.78 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.751 0.31 . . . . 0.0 110.965 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 57.41 -167.49 0.13 Allowed 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.184 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.91 -179.966 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.899 0.381 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.1 -176.64 42.0 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -70.07 149.24 47.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.833 0.349 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.1 t -94.18 -77.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.131 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 13.6 t 62.61 163.45 0.1 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.177 -179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 71.43 64.57 0.15 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.033 -179.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.464 ' O ' ' HD3' ' A' ' 9' ' ' PRO . 3.3 t -71.57 2.43 5.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.371 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.761 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.7 m -108.93 90.12 7.34 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.459 -179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 85.6 Cg_endo -84.43 -65.65 0.02 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.771 2.314 . . . . 0.0 112.716 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.3 tt0 -127.56 -81.62 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.227 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.59 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 23.4 mttt -50.23 -37.98 38.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 -179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.761 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 15.0 m95 -69.95 146.87 50.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.474 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.534 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.9 126.13 31.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.357 179.832 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.574 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.8 t-20 -107.44 152.2 24.52 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.332 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.424 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.4 m-85 -130.89 -129.44 0.2 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.136 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.8 pm0 -49.08 -45.18 42.81 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 120.727 0.298 . . . . 0.0 111.051 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.406 ' H ' ' H ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -166.33 -1.25 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.418 179.865 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.61 158.4 20.86 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.453 0.644 . . . . 0.0 110.781 179.64 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.573 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.1 t -125.03 166.2 16.79 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.861 -1.063 . . . . 0.0 110.019 179.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.666 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.43 131.77 53.5 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.994 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -97.94 109.51 22.26 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.585 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 11.3 m-30 -97.79 123.11 41.61 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.854 -178.364 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -133.45 176.77 19.46 Favored Glycine 0 C--N 1.333 0.394 0 C-N-CA 120.644 -0.788 . . . . 0.0 113.294 -179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 0.0 OUTLIER -129.37 161.26 30.71 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 120.779 0.323 . . . . 0.0 110.825 179.855 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 102.01 -123.83 8.01 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.781 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.761 HG22 ' HB3' ' A' ' 31' ' ' HIS . 0.2 OUTLIER 58.33 -165.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.806 0.336 . . . . 0.0 111.158 -179.949 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.25 -71.86 0.51 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.296 -179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.417 ' H ' ' HB2' ' A' ' 31' ' ' HIS . 17.7 mt-30 -125.79 -172.87 2.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.284 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 85.9 t90 -61.94 -50.34 72.52 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.045 -179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.513 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.9 m -55.08 -31.26 25.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.67 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.761 ' HB3' HG22 ' A' ' 26' ' ' THR . 0.2 OUTLIER -72.2 -32.04 66.43 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.646 179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.94 -48.61 52.52 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.816 0.341 . . . . 0.0 110.735 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.894 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -61.89 -38.89 90.02 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.258 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -72.52 -39.32 67.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.322 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.65 -38.8 84.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.523 -179.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 26.4 m -78.13 -25.86 47.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.905 0.384 . . . . 0.0 110.486 179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.448 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.4 OUTLIER -75.25 -22.46 57.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.983 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 39' ' ' MET . 0.1 OUTLIER -58.34 -39.76 80.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.521 -179.316 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 38' ' ' ASP . 5.2 mtt -173.45 -28.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.679 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 18.7 mm-40 -45.16 -86.97 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.582 -179.385 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 129' ' ' ARG . . . -159.99 -95.9 0.11 Allowed Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.235 -0.983 . . . . 0.0 113.541 -179.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.494 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 33.0 tt0 -152.35 162.16 41.57 Favored 'General case' 0 CA--C 1.508 -0.652 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 -178.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.894 HD13 ' HA ' ' A' ' 33' ' ' ARG . 6.9 tp -74.31 112.83 10.86 Favored 'General case' 0 N--CA 1.434 -1.274 0 N-CA-C 106.58 -1.637 . . . . 0.0 106.58 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.888 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.69 -72.53 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 113.523 -1.672 . . . . 0.0 114.308 -177.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.743 ' H ' ' H ' ' A' ' 67' ' ' GLY . 6.6 t 65.34 53.04 1.33 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.861 HD12 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -43.27 134.69 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.034 -0.985 . . . . 0.0 111.903 -178.871 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -128.99 2.08 5.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.711 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 4.0 m -120.19 122.33 28.92 Favored Pre-proline 0 N--CA 1.454 -0.261 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.121 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.438 ' HG3' ' CE2' ' A' ' 87' ' ' TYR . 81.5 Cg_exo -45.72 -30.69 6.74 Favored 'Trans proline' 0 N--CA 1.461 -0.407 0 C-N-CA 122.254 1.969 . . . . 0.0 111.561 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.503 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 23.0 tt0 -73.57 -45.13 55.18 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.856 179.283 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.531 ' CB ' HG22 ' A' ' 46' ' ' ILE . 69.8 mt-10 -63.57 -44.0 95.34 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.931 -179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.617 ' HG3' ' N ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -64.48 -40.23 95.29 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 179.341 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.617 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 19.1 t0 -68.25 -34.64 76.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.742 178.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.503 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -59.94 -51.43 69.72 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 115.34 -0.845 . . . . 0.0 111.485 -178.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.861 HD21 HD12 ' A' ' 46' ' ' ILE . 0.3 OUTLIER -74.08 -33.5 63.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.105 0.479 . . . . 0.0 110.019 179.053 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.613 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -60.68 -41.67 95.56 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.421 179.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.8 -35.09 64.86 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.049 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.59 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 17.4 t-80 -66.28 -31.42 72.21 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.782 178.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.554 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -85.45 89.58 7.73 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.953 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.04 -82.39 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.963 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 19.7 m-70 -112.83 16.71 19.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.728 179.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.554 ' O ' ' HB1' ' A' ' 59' ' ' ALA . 17.7 p -137.62 100.71 4.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.858 179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.584 ' O ' ' HB3' ' A' ' 124' ' ' ALA . . . -52.15 172.77 0.29 Allowed Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.986 -179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.24 162.7 17.45 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.595 0.236 . . . . 0.0 110.557 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.61 ' NE1' HD13 ' A' ' 122' ' ' LEU . 1.6 m-90 -108.03 132.24 53.75 Favored 'General case' 0 CA--C 1.511 -0.523 0 CA-C-O 120.885 0.374 . . . . 0.0 110.032 179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.888 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.2 pt -110.77 166.63 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.863 -178.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.743 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -75.52 58.43 2.91 Favored Glycine 0 N--CA 1.445 -0.751 0 CA-C-N 115.095 -0.957 . . . . 0.0 111.756 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.902 HD21 ' CE1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -125.46 127.25 46.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -178.585 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.566 ' N ' HD13 ' A' ' 68' ' ' LEU . 2.6 ttt180 -140.43 121.58 14.77 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.32 177.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.61 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 1.0 OUTLIER -89.87 157.82 17.72 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.858 0.361 . . . . 0.0 111.309 -179.59 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.43 ' HB3' ' H ' ' A' ' 72' ' ' ASP . 0.2 OUTLIER -62.21 -94.95 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.409 -179.338 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.43 ' H ' ' HB3' ' A' ' 71' ' ' LEU . 0.4 OUTLIER -88.32 -78.48 0.33 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.165 -179.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -154.25 -83.75 0.07 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.607 ' HG2' HD12 ' A' ' 73' ' ' LEU . 24.9 pttt -76.43 7.54 4.31 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.221 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.8 -126.85 0.13 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.594 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -127.7 145.64 50.83 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.902 ' CE1' HD21 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -87.44 151.82 22.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-O 121.482 0.658 . . . . 0.0 111.656 -179.598 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.571 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -134.11 140.83 45.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.118 -179.961 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.86 151.23 39.0 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.762 HG11 ' HB3' ' A' ' 43' ' ' LEU . 1.6 p -59.57 -21.99 22.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-O 121.236 0.541 . . . . 0.0 109.831 179.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -77.43 -9.15 58.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.568 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 91.56 41.65 5.04 Favored Glycine 0 N--CA 1.447 -0.569 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.243 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 14.9 m -130.83 123.36 28.91 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 116.925 0.362 . . . . 0.0 111.568 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.571 ' HA ' HG12 ' A' ' 78' ' ' ILE . 4.1 p80 -63.96 164.84 9.73 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.861 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.901 HG22 ' CD1' ' A' ' 77' ' ' PHE . 15.0 t -46.58 133.42 3.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.17 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.829 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -117.18 -84.18 0.64 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.143 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' CE2' ' HG3' ' A' ' 49' ' ' PRO . 69.1 t80 -88.35 -38.89 14.76 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.085 0.469 . . . . 0.0 109.872 179.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.71 171.36 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.31 -0.859 . . . . 0.0 112.129 179.563 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.603 ' HB2' ' CG ' ' A' ' 113' ' ' TRP . 67.5 m-20 -136.79 -33.81 0.77 Allowed 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.992 -1.003 . . . . 0.0 110.45 179.449 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.412 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 25.64 45.98 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.002 0.742 . . . . 0.0 113.002 178.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.778 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . 58.9 169.5 0.07 OUTLIER Pre-proline 0 CA--C 1.535 0.37 0 CA-C-O 120.487 0.184 . . . . 0.0 111.14 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.958 ' HD3' ' HG2' ' A' ' 112' ' ' ARG . 31.3 Cg_endo -63.26 -30.19 73.77 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 122.247 1.964 . . . . 0.0 112.316 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 134.54 33.78 0.29 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.557 -179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -118.68 81.37 18.42 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 120.679 0.276 . . . . 0.0 110.932 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 40.9 Cg_exo -56.96 115.71 2.69 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.626 2.217 . . . . 0.0 112.27 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.9 t -70.38 148.02 48.88 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.883 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.7 m -63.33 -46.13 88.07 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.881 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.17 83.69 7.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.762 179.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -141.93 165.07 28.48 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.061 -179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 1.5 mm-40 -150.53 -163.66 1.83 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.635 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -57.33 154.67 19.79 Favored Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.307 179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' A' ' 73' ' ' LEU . 7.2 mt-10 -90.07 166.35 13.47 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.903 0.383 . . . . 0.0 111.403 -179.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.553 ' HB3' ' SG ' ' A' ' 118' ' ' CYS . 4.8 t0 -172.6 -28.01 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.502 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.422 ' O ' ' O ' ' A' ' 116' ' ' ALA . 75.9 m -154.08 148.59 26.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.798 179.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.707 HG23 HD12 ' A' ' 68' ' ' LEU . 49.8 t -106.15 133.48 50.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.279 0.562 . . . . 0.0 111.539 -179.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.587 ' HB2' HD11 ' A' ' 122' ' ' LEU . 1.2 ptt? -118.58 167.04 12.0 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.958 179.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.517 ' HE3' ' HB3' ' A' ' 59' ' ' ALA . 0.0 OUTLIER -124.63 129.8 51.22 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.172 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.58 -166.15 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 64.77 -105.9 1.32 Allowed Glycine 0 N--CA 1.452 -0.233 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.738 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.406 ' HB2' ' CG ' ' A' ' 112' ' ' ARG . 5.7 m -83.84 35.57 0.52 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.57 0.224 . . . . 0.0 111.199 -179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.594 ' O ' HG21 ' A' ' 56' ' ' THR . . . 55.12 36.03 60.77 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.157 -179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.958 ' HG2' ' HD3' ' A' ' 92' ' ' PRO . 1.4 ppt_? -132.64 -149.94 0.4 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 111.469 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.645 ' CE3' HG11 ' A' ' 105' ' ' VAL . 25.6 m0 -107.36 161.16 15.06 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-O 121.718 0.77 . . . . 0.0 112.177 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.41 HD22 ' HE2' ' A' ' 106' ' ' MET . 3.7 m-20 -142.14 121.34 13.02 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 114.199 -1.364 . . . . 0.0 108.191 175.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 16.6 t0 -99.94 102.36 13.73 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.827 -179.279 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.422 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.74 161.87 39.79 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.89 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -40.69 149.31 0.08 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.048 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 103' ' ' ASP . 0.2 OUTLIER -73.58 68.11 1.15 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.972 0.415 . . . . 0.0 111.075 -179.732 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.99 -2.55 3.22 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.55 179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 120' ' ' ARG . 9.2 mmt180 -68.72 143.54 54.68 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.697 179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -105.0 92.81 4.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.135 -179.854 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.61 HD13 ' NE1' ' A' ' 65' ' ' TRP . 5.2 mp -85.04 -146.74 0.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.274 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.444 ' H ' ' HB3' ' A' ' 122' ' ' LEU . . . -165.39 14.17 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.951 -1.118 . . . . 0.0 113.479 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.591 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.01 134.18 17.15 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 117.123 0.461 . . . . 0.0 111.312 179.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.489 ' H ' ' HD1' ' A' ' 125' ' ' TRP . 1.1 p-90 -106.04 117.3 33.67 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.23 179.409 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.62 ' CG1' HG11 ' A' ' 44' ' ' VAL . 3.9 t -112.2 135.79 50.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.627 -178.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.442 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -136.24 166.06 24.31 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.455 -178.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.403 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 4.5 p-10 -125.96 144.15 50.81 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 121.106 0.479 . . . . 0.0 110.373 179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . 0.425 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 3.2 tpt180 -156.61 149.64 24.03 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.14 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.413 HD22 ' HA ' ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.58 137.82 57.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.806 0.336 . . . . 0.0 110.992 179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.54 140.12 2.52 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.814 -179.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 2.0 m -97.7 128.49 44.42 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.954 -0.567 . . . . 0.0 110.967 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -149.08 6.23 0.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.004 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -146.89 139.94 14.59 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.895 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.82 114.5 3.89 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.636 2.224 . . . . 0.0 112.31 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -55.57 103.54 0.11 Allowed 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.511 2.141 . . . . 0.0 112.365 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . -119.28 -61.37 1.64 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.038 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.2 m -83.53 169.86 15.0 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.853 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.76 119.05 20.01 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.886 -179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -149.18 -156.58 7.24 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.45 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 68.4 m 59.49 -89.28 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.707 0.289 . . . . 0.0 111.061 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.27 107.73 2.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.035 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.232 -0.89 . . . . 0.0 110.954 179.943 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.485 1.314 0 CA-C-O 120.764 0.316 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 119.14 115.67 2.6 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.487 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -112.73 -9.03 13.74 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.873 0.368 . . . . 0.0 110.953 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.439 ' HB ' ' HA ' ' A' ' 133' ' ' CYS . 4.4 t -112.0 -21.3 5.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.12 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 8.6 m -60.77 98.65 0.07 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.899 179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -169.37 41.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.034 -179.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -87.96 6.65 34.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.799 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.791 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.9 m -115.38 82.87 9.92 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.523 -179.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 67.7 Cg_endo -76.22 -70.48 0.02 OUTLIER 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.618 2.212 . . . . 0.0 112.535 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.487 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 1.0 OUTLIER -125.03 -78.23 0.6 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.182 -179.757 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.448 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 8.8 mtpt -50.74 -40.34 54.35 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.049 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.791 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 19.0 m95 -71.1 147.34 48.56 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.428 179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -137.73 126.23 32.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.497 -0.32 . . . . 0.0 111.478 -179.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.601 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.5 t-20 -107.01 152.33 24.13 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.292 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' CE1' ' HG2' ' A' ' 51' ' ' GLU . 5.1 m-85 -130.09 -128.57 0.21 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.979 -179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -50.82 -44.89 59.3 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.962 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -165.77 -1.61 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.528 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.44 158.32 20.83 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 121.429 0.633 . . . . 0.0 110.83 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.583 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 9.9 t -124.48 166.09 16.63 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 114.902 -1.044 . . . . 0.0 110.129 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.658 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 5.9 m-30 -124.6 132.91 53.41 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.862 -179.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.97 109.6 22.32 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.653 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.7 m-30 -99.2 124.35 44.19 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.937 -178.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.407 ' O ' ' HB1' ' A' ' 124' ' ' ALA . . . -135.59 171.31 22.69 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.755 -0.736 . . . . 0.0 113.135 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.597 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 16.5 tttp -126.02 151.12 47.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 110.993 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.539 ' N ' ' HG2' ' A' ' 24' ' ' LYS . . . 151.88 121.53 0.94 Allowed Glycine 0 N--CA 1.451 -0.309 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.425 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.652 ' HB ' HH12 ' A' ' 120' ' ' ARG . 0.0 OUTLIER -62.96 127.49 31.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.69 0.281 . . . . 0.0 111.082 -179.785 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.461 ' HD3' ' HZ3' ' A' ' 125' ' ' TRP . 0.0 OUTLIER -172.64 -149.24 0.05 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.811 179.928 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -127.18 174.35 8.99 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.923 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.474 ' CH2' ' HB2' ' A' ' 69' ' ' ARG . 82.5 t90 -64.21 -49.52 71.65 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.001 -179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 7.8 m -55.23 -31.29 26.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.661 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.414 ' CG ' ' HG2' ' A' ' 27' ' ' LYS . 45.2 m-70 -72.8 -31.77 65.07 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.605 179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.92 -48.74 51.93 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.697 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.956 ' HA ' HD13 ' A' ' 43' ' ' LEU . 3.9 ppt_? -59.66 -39.52 84.71 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -72.66 -35.72 67.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.236 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -68.85 -39.8 79.7 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.475 -179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.656 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 8.0 m -77.24 -26.27 52.4 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.939 0.399 . . . . 0.0 110.356 179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -75.07 -23.02 57.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.915 179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.21 -39.37 78.85 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.483 -179.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -176.64 -27.76 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.581 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.656 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 48.2 mm-40 -45.86 -85.65 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.393 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.417 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -160.09 -97.28 0.12 Allowed Glycine 0 C--N 1.331 0.285 0 C-N-CA 120.211 -0.995 . . . . 0.0 113.375 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.546 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 35.4 tt0 -152.45 162.32 41.35 Favored 'General case' 0 CA--C 1.508 -0.669 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 -178.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.956 HD13 ' HA ' ' A' ' 33' ' ' ARG . 5.7 tp -74.0 113.06 10.74 Favored 'General case' 0 N--CA 1.434 -1.239 0 C-N-CA 117.822 -1.551 . . . . 0.0 106.84 179.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.936 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -23.22 -68.79 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 113.415 -1.72 . . . . 0.0 114.051 -177.45 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.746 ' H ' ' H ' ' A' ' 67' ' ' GLY . 1.1 t 62.43 55.55 2.27 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -178.271 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.772 HD13 HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -47.51 138.15 2.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 114.873 -1.058 . . . . 0.0 112.01 -178.658 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 19.6 p-80 -132.06 -0.73 3.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.801 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.454 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 1.2 t -117.9 122.1 30.92 Favored Pre-proline 0 N--CA 1.453 -0.304 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.263 179.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 82.4 Cg_exo -45.69 -30.01 5.98 Favored 'Trans proline' 0 N--CA 1.463 -0.316 0 C-N-CA 122.246 1.964 . . . . 0.0 111.657 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.485 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 18.2 tt0 -73.41 -45.89 51.93 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.71 179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.506 ' HB2' HG22 ' A' ' 46' ' ' ILE . 59.0 mt-10 -63.65 -43.71 95.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.629 -179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.681 ' HB2' ' HE1' ' A' ' 113' ' ' TRP . 0.0 OUTLIER -63.82 -41.42 97.86 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.341 -0.39 . . . . 0.0 109.964 179.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.612 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 17.7 t70 -67.37 -34.83 78.12 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.753 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.485 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -60.32 -51.51 69.21 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.613 -178.873 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.772 HD21 HD13 ' A' ' 46' ' ' ILE . 0.4 OUTLIER -74.81 -37.46 62.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.166 0.508 . . . . 0.0 110.373 179.046 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.72 HG21 ' O ' ' A' ' 111' ' ' GLY . 0.8 OUTLIER -60.39 -38.7 84.77 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.388 -0.823 . . . . 0.0 109.555 -179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.558 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 0.0 OUTLIER -76.03 -34.9 59.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 178.411 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.448 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 27.5 t-80 -66.89 -29.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.01 179.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 62' ' ' THR . . . -61.23 96.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.241 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 14.3 m -84.84 93.03 8.41 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.742 179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 60.01 15.86 5.41 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.777 -179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.452 ' HB ' ' C ' ' A' ' 123' ' ' GLY . 4.2 p -149.45 106.09 3.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.687 -179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.661 ' HA3' HD23 ' A' ' 122' ' ' LEU . . . -53.22 168.71 1.01 Allowed Glycine 0 C--N 1.33 0.223 0 C-N-CA 121.037 -0.602 . . . . 0.0 112.942 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.48 ' HB2' ' CG2' ' A' ' 126' ' ' VAL . 49.8 p -112.7 161.98 16.25 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.485 0.183 . . . . 0.0 110.658 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.732 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.2 m-90 -106.0 132.62 51.87 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.534 179.796 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.936 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.6 pt -114.79 167.67 7.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.453 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.746 ' H ' ' H ' ' A' ' 45' ' ' SER . . . -72.63 55.07 1.66 Allowed Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.399 -0.819 . . . . 0.0 112.358 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.637 HD12 HD11 ' A' ' 66' ' ' ILE . 4.5 mt -125.86 128.38 47.53 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 -179.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.474 ' HB2' ' CH2' ' A' ' 29' ' ' TRP . 6.6 ttt180 -138.34 120.78 16.03 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.553 -1.203 . . . . 0.0 109.354 178.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.565 ' HA ' ' HA ' ' A' ' 77' ' ' PHE . 0.6 OUTLIER -89.76 155.3 19.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.894 0.378 . . . . 0.0 110.993 -179.509 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.2 mt -74.19 80.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.799 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 62.28 -83.37 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.895 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.423 ' HA ' HD21 ' A' ' 70' ' ' ASN . 0.2 OUTLIER -156.97 34.97 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.74 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.93 -18.22 59.44 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.997 -179.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 95.56 9.49 57.64 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.805 179.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.56 124.97 39.43 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.719 0.259 . . . . 0.0 110.378 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.719 ' CZ ' HG13 ' A' ' 85' ' ' VAL . 0.3 OUTLIER -93.87 150.01 20.74 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-O 121.477 0.656 . . . . 0.0 111.493 -179.567 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.57 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -130.98 140.22 49.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.147 -0.933 . . . . 0.0 109.492 179.692 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.639 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 7.0 m0 -74.39 148.0 41.61 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 120.741 -0.383 . . . . 0.0 110.409 -179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.678 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -59.87 -21.68 22.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.35 0.595 . . . . 0.0 109.614 179.332 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -76.75 -9.87 58.98 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.55 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 93.56 40.13 4.82 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.865 -0.607 . . . . 0.0 113.399 179.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -134.55 121.25 20.7 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 116.945 0.372 . . . . 0.0 111.384 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.57 ' HA ' HG12 ' A' ' 78' ' ' ILE . 8.4 p80 -63.32 162.01 12.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.594 0.235 . . . . 0.0 111.15 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.719 HG13 ' CZ ' ' A' ' 77' ' ' PHE . 21.9 t -35.64 128.76 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.462 0.163 0 CA-C-N 115.964 -0.562 . . . . 0.0 112.379 -179.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -114.63 -80.57 0.6 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.222 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -92.31 -38.45 12.05 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.002 179.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.441 ' HB3' HG13 ' A' ' 85' ' ' VAL . 0.1 OUTLIER 50.67 -178.75 0.02 OUTLIER 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.051 179.513 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.618 ' HB2' ' CD2' ' A' ' 113' ' ' TRP . 24.9 m-20 -142.48 -31.5 0.52 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.835 -1.075 . . . . 0.0 110.645 179.538 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.474 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.4 m0 18.56 99.8 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 178.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 113' ' ' TRP . . . -43.11 110.84 0.95 Allowed Pre-proline 0 N--CA 1.464 0.242 0 CA-C-O 120.681 0.277 . . . . 0.0 111.489 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -61.75 128.17 23.68 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 122.656 2.237 . . . . 0.0 112.261 -179.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 92.91 12.14 58.15 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.477 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -114.13 88.83 15.6 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.627 0.251 . . . . 0.0 110.879 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.63 116.89 4.89 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.557 2.171 . . . . 0.0 112.292 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 22.5 p -74.28 131.24 41.0 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.965 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.67 -179.27 6.84 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.897 179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 4.8 mmt180 -107.04 121.79 45.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.905 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -159.76 -169.22 2.48 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.837 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -126.69 128.18 46.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -178.39 -143.11 5.04 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.586 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . 0.593 ' HB3' ' HB2' ' A' ' 118' ' ' CYS . 0.3 OUTLIER -83.74 -153.92 0.15 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.742 0.306 . . . . 0.0 110.906 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.416 ' HB3' HD22 ' A' ' 70' ' ' ASN . 0.1 OUTLIER -167.19 98.13 0.51 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.8 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 116' ' ' ALA . 0.0 OUTLIER -157.13 158.3 36.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 121.265 0.555 . . . . 0.0 111.194 -179.723 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.441 HG11 ' CE3' ' A' ' 113' ' ' TRP . 36.4 t -105.17 135.47 43.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.818 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.804 ' HB3' HD11 ' A' ' 122' ' ' LEU . 3.0 ptp -129.31 168.81 15.69 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.544 -179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.537 ' HE3' HG23 ' A' ' 56' ' ' THR . 0.4 OUTLIER -121.04 142.65 49.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.009 0.433 . . . . 0.0 110.188 179.12 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.449 ' HA ' ' HE1' ' A' ' 107' ' ' MET . 18.3 ptt85 173.15 -178.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.044 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 79.58 -120.61 5.29 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.83 179.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.514 ' HB2' ' NE ' ' A' ' 112' ' ' ARG . 66.8 m -66.82 -30.73 70.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.799 0.333 . . . . 0.0 111.245 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.72 ' O ' HG21 ' A' ' 56' ' ' THR . . . 131.64 31.61 0.5 Allowed Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 120.833 -0.698 . . . . 0.0 111.798 -179.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.514 ' NE ' ' HB2' ' A' ' 110' ' ' SER . 1.1 ptp180 -126.73 -149.91 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 111.09 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.681 ' HE1' ' HB2' ' A' ' 52' ' ' GLN . 42.2 m0 -107.41 163.2 13.25 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 121.631 0.729 . . . . 0.0 112.034 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 26.9 m-80 -141.54 120.03 12.4 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 114.178 -1.374 . . . . 0.0 107.798 175.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -95.71 105.76 17.8 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.321 -179.353 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.415 ' O ' ' O ' ' A' ' 104' ' ' CYS . . . -156.57 162.18 39.92 Favored 'General case' 0 N--CA 1.455 -0.192 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.029 -179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.403 ' C ' ' O ' ' A' ' 116' ' ' ALA . 48.8 m-85 -33.36 -88.74 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.472 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 102' ' ' GLU . 0.2 OUTLIER 162.44 -88.42 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 122.554 0.342 . . . . 0.0 110.661 179.437 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 54.39 37.09 26.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.415 179.677 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.652 HH12 ' HB ' ' A' ' 26' ' ' THR . 0.0 OUTLIER 60.6 122.06 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 120.946 0.403 . . . . 0.0 111.306 179.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.64 -32.69 0.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.631 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.804 HD11 ' HB3' ' A' ' 106' ' ' MET . 2.6 mp -85.36 -172.05 3.94 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.975 0.417 . . . . 0.0 111.628 -179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . 0.452 ' C ' ' HB ' ' A' ' 62' ' ' THR . . . -159.56 23.71 0.3 Allowed Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.614 -179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.597 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -150.0 135.11 17.94 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.783 0.292 . . . . 0.0 110.752 179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.486 ' HA ' ' HE3' ' A' ' 65' ' ' TRP . 0.0 OUTLIER -105.62 119.8 40.06 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 121.087 0.47 . . . . 0.0 111.033 -179.939 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.609 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.3 t -113.15 136.24 50.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.455 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.559 -179.879 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.7 m -136.65 165.63 25.43 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.449 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.417 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 3.2 p-10 -126.3 143.8 51.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.114 0.483 . . . . 0.0 110.295 179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.11 148.51 22.13 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.273 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.85 143.95 56.57 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.692 0.282 . . . . 0.0 110.802 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -44.36 152.68 0.18 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.711 -179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . . . . . . . . . 30.5 m -94.59 98.22 10.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.053 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . 0.439 ' HA ' ' HB ' ' A' ' 4' ' ' VAL . 0.5 OUTLIER -121.82 97.49 5.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.926 -179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.417 ' OG1' HG11 ' A' ' 4' ' ' VAL . 3.9 m -74.91 115.82 48.05 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.811 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.72 137.55 35.84 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 122.485 2.124 . . . . 0.0 112.325 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -74.49 3.94 4.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.622 2.214 . . . . 0.0 112.404 179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.39 -166.74 0.15 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.218 -179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -67.56 164.78 18.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.924 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.6 -49.85 0.6 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.844 -179.966 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -70.79 120.39 8.81 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.452 -179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 1.4 p -140.66 -59.64 0.51 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.875 0.369 . . . . 0.0 110.896 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -100.32 72.36 1.61 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.083 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.009 179.97 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.808 0.337 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.09 118.34 0.44 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.552 -179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 59.71 -89.57 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.718 0.294 . . . . 0.0 111.181 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.593 HG12 HG22 ' A' ' 132' ' ' THR . 14.6 m -60.21 153.88 4.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.235 -179.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.407 ' O ' ' HB2' ' A' ' 6' ' ' ASN . 5.4 p -124.05 -8.77 7.7 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.901 179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' A' ' 5' ' ' CYS . 1.9 m-80 73.4 66.83 0.1 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.07 -179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.514 HG22 ' HA ' ' A' ' 131' ' ' ALA . 6.2 t -77.8 13.41 1.35 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.346 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.805 ' HA ' ' HB2' ' A' ' 12' ' ' TRP . 2.4 m -114.15 86.29 11.47 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 120.812 0.339 . . . . 0.0 111.691 -179.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.549 ' HD2' ' HB2' ' A' ' 12' ' ' TRP . 74.0 Cg_endo -77.13 -64.39 0.02 OUTLIER 'Trans proline' 0 C--N 1.348 0.505 0 C-N-CA 122.619 2.213 . . . . 0.0 112.606 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' H ' ' HG2' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -132.31 -76.79 0.5 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.3 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.542 ' HA ' ' NE2' ' A' ' 58' ' ' HIS . 24.6 mtpt -52.8 -37.71 60.16 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' TRP . . . . . 0.805 ' HB2' ' HA ' ' A' ' 8' ' ' CYS . 18.2 m95 -71.89 145.39 48.55 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.586 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.547 ' O ' ' HA ' ' A' ' 19' ' ' CYS . 0.0 OUTLIER -135.21 126.15 45.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.371 179.978 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.625 ' HB2' ' SG ' ' A' ' 8' ' ' CYS . 22.7 t-20 -106.0 152.45 23.34 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.926 0.393 . . . . 0.0 111.403 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.402 ' HE1' ' CD1' ' A' ' 20' ' ' TYR . 5.2 m-85 -130.8 -128.24 0.2 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.926 -179.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -51.04 -45.46 61.32 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-O 120.775 0.322 . . . . 0.0 111.074 -179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.423 ' H ' ' H ' ' A' ' 18' ' ' LYS . 3.3 ptt180 -164.83 -2.37 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.402 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.423 ' H ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -113.27 158.32 20.67 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.612 0.72 . . . . 0.0 110.87 179.552 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.586 ' HA ' ' HA ' ' A' ' 14' ' ' ASN . 10.4 t -124.15 166.49 15.73 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.681 179.23 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.686 ' O ' ' HA ' ' A' ' 12' ' ' TRP . 6.0 m-30 -123.89 134.01 53.64 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.235 -0.439 . . . . 0.0 109.899 -179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -97.68 109.52 22.26 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.696 ' CZ ' ' HB3' ' A' ' 55' ' ' LEU . 10.6 m-30 -101.64 127.84 48.19 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.396 -177.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.08 -177.88 21.96 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.455 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 124' ' ' ALA . 30.9 mttm -114.55 160.6 19.07 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.844 0.354 . . . . 0.0 110.806 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.473 ' HA3' ' NE1' ' A' ' 125' ' ' TRP . . . -175.68 -161.77 25.61 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.659 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -169.22 81.82 0.13 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.962 0.411 . . . . 0.0 110.801 179.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' H ' ' HH2' ' A' ' 65' ' ' TRP . 22.7 mmtm -153.57 -139.74 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.823 -179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.507 ' H ' ' HB3' ' A' ' 27' ' ' LYS . 47.5 mt-30 -119.61 -177.62 3.42 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.737 0.303 . . . . 0.0 110.903 -179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.0 t90 -65.54 -48.92 70.8 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.986 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.603 ' O ' ' HG3' ' A' ' 33' ' ' ARG . 6.4 m -55.16 -31.08 25.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.88 179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -72.37 -32.37 66.37 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.676 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -70.91 -48.49 53.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 110.612 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.939 ' HA ' HD13 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -60.05 -40.34 89.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.027 179.613 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.36 -33.93 67.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.035 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.65 85.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.458 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.739 ' HA ' ' HB2' ' A' ' 40' ' ' GLU . 3.8 m -79.14 -24.56 43.25 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.434 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 12.2 t70 -75.04 -21.26 59.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.074 179.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -58.09 -39.36 78.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.375 -179.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 5.0 ptp -179.24 -26.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.471 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.739 ' HB2' ' HA ' ' A' ' 36' ' ' CYS . 4.0 mp0 -45.78 -91.95 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.541 -179.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.418 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -150.05 -96.93 0.16 Allowed Glycine 0 C--N 1.331 0.296 0 C-N-CA 120.231 -0.985 . . . . 0.0 113.411 -179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLN . . . . . 0.515 ' HG2' ' N ' ' A' ' 43' ' ' LEU . 34.7 tt0 -153.7 162.23 41.43 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 -178.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.939 HD13 ' HA ' ' A' ' 33' ' ' ARG . 7.7 tp -74.29 112.94 10.95 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 178.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.954 HG23 ' HA ' ' A' ' 66' ' ' ILE . 0.0 OUTLIER -22.33 -71.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 113.446 -1.706 . . . . 0.0 114.198 -177.457 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.721 ' H ' ' H ' ' A' ' 67' ' ' GLY . 3.1 t 64.59 57.84 1.08 Allowed 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.317 0.579 . . . . 0.0 109.808 -178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.719 HG22 ' HB2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -48.98 145.97 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.192 -0.913 . . . . 0.0 112.061 -179.103 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -138.5 0.43 2.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.041 179.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.528 ' HB3' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -123.4 124.27 26.35 Favored Pre-proline 0 N--CA 1.454 -0.25 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.321 179.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.514 ' O ' ' HG3' ' A' ' 52' ' ' GLN . 84.1 Cg_exo -46.34 -28.14 5.55 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.388 2.058 . . . . 0.0 111.794 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.469 ' HG2' ' HD2' ' A' ' 54' ' ' PHE . 16.3 tt0 -73.26 -47.68 41.1 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.825 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.719 ' HB2' HG22 ' A' ' 46' ' ' ILE . 28.8 mt-10 -64.7 -42.08 95.56 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.508 -179.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.696 ' HG2' HD21 ' A' ' 89' ' ' ASN . 0.0 OUTLIER -63.27 -42.29 99.12 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 179.244 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' LYS . 18.1 t70 -67.6 -35.27 78.66 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.584 178.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.469 ' HD2' ' HG2' ' A' ' 50' ' ' GLU . 0.3 OUTLIER -60.68 -51.23 70.27 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.898 -178.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.718 HD21 HD13 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -74.07 -40.41 62.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.884 179.617 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.655 ' HB ' ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -59.83 -38.58 82.42 Favored 'General case' 0 N--CA 1.449 -0.48 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 53' ' ' ASP . 4.0 tppt? -74.25 -34.69 63.71 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.216 178.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 11' ' ' LYS . 39.0 t-80 -66.78 -30.92 71.24 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.205 179.311 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -74.13 109.74 7.86 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.013 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -90.36 -28.92 18.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.024 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -65.97 -69.22 0.31 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.916 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.06 -55.41 0.13 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.542 ' C ' HD23 ' A' ' 122' ' ' LEU . . . -163.87 -170.7 29.15 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.454 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.577 ' H ' ' HG3' ' A' ' 107' ' ' MET . 9.6 p -125.53 163.16 23.3 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 110.463 -0.199 . . . . 0.0 110.463 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.602 ' NE1' HD13 ' A' ' 122' ' ' LEU . 2.1 m-90 -102.06 132.14 48.1 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 120.686 -0.405 . . . . 0.0 110.115 179.553 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.954 ' HA ' HG23 ' A' ' 44' ' ' VAL . 1.3 pt -114.26 166.92 7.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.52 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.778 ' HA2' HD23 ' A' ' 43' ' ' LEU . . . -75.1 58.38 2.73 Favored Glycine 0 N--CA 1.446 -0.651 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.695 179.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.9 HD21 ' CD1' ' A' ' 77' ' ' PHE . 0.3 OUTLIER -126.17 127.81 46.3 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 113.693 0.997 . . . . 0.0 113.693 -178.452 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.583 ' N ' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -139.36 121.01 15.26 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 114.719 -1.128 . . . . 0.0 109.034 177.432 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.712 ' HB3' ' HB3' ' A' ' 103' ' ' ASP . 4.8 t-20 -89.65 158.72 17.47 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.764 0.316 . . . . 0.0 111.443 -179.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.23 -8.67 18.17 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.77 -179.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -152.7 26.92 0.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.573 0.225 . . . . 0.0 111.301 -179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 100' ' ' GLN . 2.7 mp 59.28 -87.06 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.905 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -83.41 -2.28 55.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.851 0.358 . . . . 0.0 110.724 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.54 -108.84 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.502 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.9 124.78 38.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.712 0.292 . . . . 0.0 110.592 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.903 ' CD1' HG22 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -86.83 151.71 23.11 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 121.517 0.675 . . . . 0.0 111.916 -179.414 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.538 HG12 ' HA ' ' A' ' 84' ' ' HIS . 0.1 OUTLIER -133.24 140.81 46.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 CA-C-N 114.942 -1.026 . . . . 0.0 109.924 -179.984 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.607 ' HE1' ' HE1' ' A' ' 77' ' ' PHE . 4.9 m0 -74.96 156.88 35.83 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' ' 43' ' ' LEU . 0.9 OUTLIER -60.36 -23.94 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 121.31 0.576 . . . . 0.0 109.529 179.458 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -77.34 -8.39 57.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.44 179.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.69 42.45 5.74 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.794 -0.639 . . . . 0.0 113.009 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.429 ' HB2' ' CD2' ' A' ' 79' ' ' TRP . 43.4 m -124.85 126.62 45.86 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 120.83 0.348 . . . . 0.0 111.736 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.538 ' HA ' HG12 ' A' ' 78' ' ' ILE . 30.3 t60 -66.16 157.01 32.37 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.658 179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.903 HG22 ' CD1' ' A' ' 77' ' ' PHE . 17.7 t -42.62 130.24 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.021 0.439 . . . . 0.0 111.718 -179.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.412 ' HB2' ' HZ2' ' A' ' 79' ' ' TRP . 2.9 m-20 -114.8 -82.34 0.61 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.333 179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -87.18 -41.69 13.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.015 0.436 . . . . 0.0 110.173 179.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER 53.73 169.07 0.02 OUTLIER 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.065 179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASN . . . . . 0.696 HD21 ' HG2' ' A' ' 52' ' ' GLN . 52.9 m-20 -132.06 -33.83 1.31 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.608 179.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.463 ' C ' ' O ' ' A' ' 89' ' ' ASN . 11.2 m0 21.3 99.08 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 113' ' ' TRP . . . -41.08 142.04 0.92 Allowed Pre-proline 0 N--CA 1.462 0.16 0 CA-C-O 120.7 0.286 . . . . 0.0 111.488 179.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -71.1 -7.45 21.43 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.518 2.146 . . . . 0.0 112.252 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -72.96 -108.51 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.435 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -145.0 85.93 7.96 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 120.769 0.318 . . . . 0.0 110.9 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -72.52 -3.18 12.96 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.596 2.197 . . . . 0.0 112.311 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.05 135.58 53.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.926 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 t -146.27 163.76 34.48 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.881 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.18 95.6 5.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.925 179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.0 m -161.59 -178.64 6.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.887 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLN . . . . . 0.402 ' HA ' HD11 ' A' ' 73' ' ' LEU . 3.1 tt0 -152.76 135.25 15.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.936 -179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . 138.21 -144.37 15.56 Favored Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.793 -0.717 . . . . 0.0 112.46 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -88.24 99.88 12.56 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.769 0.319 . . . . 0.0 110.933 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.712 ' HB3' ' HB3' ' A' ' 70' ' ' ASN . 6.8 t70 -73.95 163.42 27.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.88 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -149.43 153.02 36.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.785 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.721 HG23 HD12 ' A' ' 68' ' ' LEU . 41.9 t -105.86 125.57 61.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.051 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' MET . . . . . 0.459 ' CB ' HD11 ' A' ' 122' ' ' LEU . 17.9 ptm -118.64 169.05 10.14 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.394 -179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' MET . . . . . 0.577 ' HG3' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -121.1 130.41 53.74 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.101 0.477 . . . . 0.0 110.718 179.899 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.405 ' O ' ' HD2' ' A' ' 112' ' ' ARG . 0.0 OUTLIER 176.75 -166.8 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.798 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.496 ' HA3' ' CZ ' ' A' ' 112' ' ' ARG . . . 83.98 -54.81 4.98 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.744 179.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 52.0 m -154.69 -11.55 0.13 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.632 0.253 . . . . 0.0 111.237 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . 0.622 ' O ' HG21 ' A' ' 56' ' ' THR . . . 127.38 14.87 2.57 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.678 -0.773 . . . . 0.0 112.169 -179.618 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.496 ' CZ ' ' HA3' ' A' ' 109' ' ' GLY . 0.8 OUTLIER -112.83 -153.45 0.52 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.901 0.382 . . . . 0.0 111.092 -179.924 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TRP . . . . . 0.684 ' CG ' ' HB2' ' A' ' 89' ' ' ASN . 34.4 m0 -107.97 162.36 14.1 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.798 0.808 . . . . 0.0 112.286 -179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -141.38 120.37 12.8 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 113.865 -1.516 . . . . 0.0 107.532 175.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.2 t0 -100.38 96.63 7.55 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.299 -179.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -156.77 161.28 39.79 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.305 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -48.86 156.81 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.945 179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.26 64.86 4.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.078 -179.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.413 ' OD1' ' HG2' ' A' ' 120' ' ' ARG . 3.1 p30 -97.78 -15.57 20.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.628 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.43 HH11 ' HD3' ' A' ' 120' ' ' ARG . 0.6 OUTLIER -99.58 -162.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.647 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.02 121.95 4.52 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.035 179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.602 HD13 ' NE1' ' A' ' 65' ' ' TRP . 6.1 mp -85.48 -152.67 0.16 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.575 179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -163.16 26.85 0.22 Allowed Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.202 -0.999 . . . . 0.0 113.376 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . . . -146.49 131.74 18.46 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.066 0.46 . . . . 0.0 111.719 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' TRP . . . . . 0.473 ' NE1' ' HA3' ' A' ' 25' ' ' GLY . 32.7 m0 -98.64 103.97 15.97 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.489 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.658 ' CG1' HG11 ' A' ' 44' ' ' VAL . 4.6 t -113.17 129.97 67.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 CA-C-O 121.259 0.552 . . . . 0.0 110.605 -179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.409 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 2.5 m -137.33 167.02 22.41 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.014 -178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.418 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.0 OUTLIER -125.72 142.93 51.27 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.271 0.558 . . . . 0.0 110.402 179.876 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.11 159.29 36.08 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.41 -0.814 . . . . 0.0 109.675 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 130' ' ' LEU . 0.1 OUTLIER -66.67 138.45 57.44 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.917 0.389 . . . . 0.0 110.744 179.692 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ALA . . . . . 0.514 ' HA ' HG22 ' A' ' 7' ' ' THR . . . -60.18 -2.5 0.45 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -179.034 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' THR . . . . . 0.593 HG22 HG12 ' A' ' 4' ' ' VAL . 19.0 p -94.6 127.85 40.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.913 0.387 . . . . 0.0 110.997 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 3.1 p -85.58 3.55 40.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.029 -179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.7 t -132.52 129.38 21.4 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -72.01 117.61 5.22 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.587 2.191 . . . . 0.0 112.339 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -71.55 -4.59 15.32 Favored 'Trans proline' 0 C--N 1.345 0.391 0 C-N-CA 122.574 2.183 . . . . 0.0 112.348 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ALA . . . . . . . . . . . . . . . 58.21 -168.67 0.13 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.246 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -73.67 165.81 24.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.906 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.67 -61.03 0.11 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.869 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -142.38 -32.69 0.11 Allowed Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.445 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 38.7 m 59.34 -90.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.661 0.267 . . . . 0.0 111.077 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -97.75 67.9 2.03 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.126 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.236 -0.888 . . . . 0.0 110.869 -179.926 . . . . . . . . 0 0 . 1 stop_ save_