data_1h3h_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 1h3h _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 19' ' ' ARG . . . . . 0.493 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.625 0.25 . . . . 0.0 111.509 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.673 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.417 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.616 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.462 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.695 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.616 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.55 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.471 HG11 ' O ' ' A' ' 57' ' ' ARG . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.493 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.453 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.673 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.462 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.608 HH11 HD22 ' A' ' 62' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.71 ' HB2' HD23 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.608 HD22 HH11 ' A' ' 57' ' ' ARG . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.695 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.674 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.419 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.673 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.419 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.709 0.212 . . . . 0.0 112.286 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.674 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.52 ' O ' HG21 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.535 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.52 HG21 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.673 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.559 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.695 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.451 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.622 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.441 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.431 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.47 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.631 HD23 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.559 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.524 ' N ' HG11 ' A' ' 45' ' ' VAL . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.448 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.429 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.812 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.458 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB2' HD23 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.564 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.651 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.622 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.695 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? . . . . . 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.816 0.257 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.651 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.558 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.461 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.837 0.351 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.682 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.541 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.486 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.421 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.622 ' HG2' ' HZ3' ' B' ' 84' ' ' LYS . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.472 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.58 HG23 ' HB2' ' A' ' 58' ' ' LEU . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.469 ' N ' HG11 ' A' ' 43' ' ' VAL . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.428 ' H ' ' HA3' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.426 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.453 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.406 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.56 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.428 ' HA3' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HB3' HD21 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.58 ' HB2' HG23 ' A' ' 43' ' ' VAL . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 67' ' ' ALA . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.542 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.471 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.682 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.23 0.096 0 CA-C-O 120.849 0.27 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.57 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.622 ' HZ3' ' HG2' ' A' ' 31' ' ' GLU . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.539 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.626 0.25 . . . . 0.0 111.062 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.622 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.563 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 35' ' ' LEU . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.764 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.549 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.623 HG23 ' HB2' ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.539 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.42 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.449 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.728 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.494 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.474 ' HG1' HD21 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HB2' HG23 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.764 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.549 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.566 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.482 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.457 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo . . . . . 0 N--CA 1.467 -0.088 0 CA-C-O 120.903 0.293 . . . . 0.0 112.44 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.566 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.528 ' O ' HG21 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.493 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.528 HG21 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.493 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.425 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.897 0.38 . . . . 0.0 110.943 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.778 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.592 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.472 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.476 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.484 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.424 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.683 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 58' ' ' LEU . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.425 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.713 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.47 ' HB3' ' HA ' ' A' ' 48' ' ' SER . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' HG11 ' A' ' 43' ' ' VAL . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.696 HD11 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.423 HD21 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.683 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.426 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.746 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.727 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.778 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 CA-C-O 120.899 0.291 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.746 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.421 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.426 ' HG1' ' HD1' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.436 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.713 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.5 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.918 0.389 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.646 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB3' HG23 ' A' ' 70' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.561 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.493 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.493 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.593 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.695 HD23 ' H ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.59 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.456 HG11 ' N ' ' A' ' 44' ' ' GLU . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.456 ' N ' HG11 ' A' ' 43' ' ' VAL . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.437 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.509 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.6 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.448 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.408 ' O ' HG11 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 35' ' ' LEU . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.593 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.59 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.722 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.646 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.404 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.936 0.307 . . . . 0.0 112.818 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.722 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.511 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.441 HG22 ' HB2' ' A' ' 52' ' ' SER . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.492 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.002 0.43 . . . . 0.0 110.218 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.738 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.571 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.436 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.501 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.616 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.54 HD23 ' H ' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.584 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.421 HG23 ' HB2' ' A' ' 58' ' ' LEU . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.519 HG22 ' CA ' ' A' ' 20' ' ' TRP . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.48 HD22 ' HA ' ' B' ' 85' ' ' PRO . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HG2' ' HG1' ' B' ' 83' ' ' THR . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.574 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.744 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.454 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.54 ' H ' HD23 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.449 ' HA2' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.616 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.511 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.584 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.702 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.738 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.692 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.23 0.093 0 CA-C-O 120.834 0.264 . . . . 0.0 112.314 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.702 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 52' ' ' SER . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HG2' HD11 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.007 0.432 . . . . 0.0 110.753 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.797 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.404 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.601 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.436 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.496 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.473 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.485 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.578 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 58' ' ' LEU . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.501 HG22 ' N ' ' A' ' 20' ' ' TRP . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.454 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.466 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.425 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.427 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.466 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.64 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.473 ' HA2' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 53' ' ' TRP . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.497 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.578 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.431 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.464 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.688 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.797 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo . . . . . 0 C--O 1.231 0.143 0 CA-C-O 120.844 0.268 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.508 HG21 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.515 ' O ' HG21 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.488 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.515 HG21 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.487 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.705 0.288 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.679 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.423 ' CB ' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.486 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.486 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.762 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.428 ' CD1' ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.537 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.517 HG21 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.476 ' N ' HG11 ' A' ' 43' ' ' VAL . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.487 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' HG11 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.433 ' OG ' HG13 ' A' ' 45' ' ' VAL . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.441 HD22 ' HA ' ' B' ' 85' ' ' PRO . 4.5 m-20 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.615 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.437 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB2' HG21 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.762 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.427 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.732 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.532 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.679 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.474 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo . . . . . 0 CA--C 1.526 0.092 0 CA-C-O 120.817 0.257 . . . . 0.0 112.193 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.732 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.472 ' O ' HG21 ' B' ' 83' ' ' THR . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.497 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.472 HG21 ' O ' ' B' ' 80' ' ' ASP . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.505 ' HG2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.615 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.584 0.231 . . . . 0.0 111.538 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.663 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.525 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.425 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.517 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.517 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.483 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.443 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.681 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.509 HD23 ' H ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.707 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' A' ' 21' ' ' ALA . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.544 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.457 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.633 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.459 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.544 ' HG2' HD13 ' A' ' 46' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.681 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.468 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.562 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.525 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.663 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.833 0.264 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.468 HG21 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.521 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.501 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.657 0.265 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.661 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.44 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.617 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.444 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.827 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.402 HD13 ' NH1' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.781 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.569 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.529 HG11 ' N ' ' A' ' 44' ' ' GLU . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.529 ' N ' HG11 ' A' ' 43' ' ' VAL . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.501 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.464 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.46 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.597 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.464 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.402 ' H ' ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.781 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.827 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.709 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.444 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.617 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.661 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.232 0.201 0 CA-C-O 120.768 0.236 . . . . 0.0 112.163 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.709 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.432 ' O ' HG21 ' B' ' 83' ' ' THR . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.524 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 121.074 0.464 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.733 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.551 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.471 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.668 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.591 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.405 HD12 ' CB ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.668 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.513 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.497 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . 0.555 HG12 ' HE1' ' A' ' 73' ' ' MET . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.614 HG23 ' HB2' ' A' ' 58' ' ' LEU . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.524 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.486 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.663 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.578 ' HG2' HD13 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.614 ' HB2' HG23 ' A' ' 43' ' ' VAL . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.591 ' N ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.494 ' CE1' HG23 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.483 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.41 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.659 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.733 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.661 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.406 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo . . . . . 0 C--O 1.23 0.085 0 CA-C-O 120.831 0.263 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.659 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.663 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.531 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 . . . . . 0 N--CA 1.457 -0.082 0 CA-C-O 120.985 0.422 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.669 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.665 ' HB1' HG23 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.57 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.407 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.502 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.486 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.607 ' HG3' ' HZ1' ' B' ' 84' ' ' LYS . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.825 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.61 HG23 ' HB2' ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.409 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.614 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.454 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' VAL . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.444 ' HE2' HD21 ' A' ' 58' ' ' LEU . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.825 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.783 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.894 HD22 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.665 HG23 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.669 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.846 0.269 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.894 HG12 HD22 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.472 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.607 ' HZ1' ' HG3' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.52 ' HA ' ' HG ' ' A' ' 48' ' ' SER . 8.4 ptt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.826 0.346 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.821 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.429 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.463 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.463 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.517 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.587 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.591 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.559 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.488 HG11 ' N ' ' A' ' 44' ' ' GLU . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.488 ' N ' HG11 ' A' ' 43' ' ' VAL . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.485 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.505 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.52 ' HG ' ' HA ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.455 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.769 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.492 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.505 ' HB ' ' HB2' ' A' ' 47' ' ' ASP . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 37' ' ' PHE . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.512 ' HB2' HD22 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.587 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.429 ' CE1' ' HB1' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.61 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.764 HD22 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.821 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.631 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo . . . . . 0 N--CA 1.465 -0.157 0 CA-C-O 120.776 0.24 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.764 HG12 HD22 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.769 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.567 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.611 0.243 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.641 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 43' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.573 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.455 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.51 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.484 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 57' ' ' ARG . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.72 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.537 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.497 ' HB ' ' O ' ' A' ' 21' ' ' ALA . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.567 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 5.9 m-20 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.541 ' HB2' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.645 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.543 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.511 ' HA ' HD23 ' A' ' 35' ' ' LEU . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.411 ' O ' HD12 ' A' ' 35' ' ' LEU . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.625 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.573 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.641 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 CA--C 1.528 0.195 0 CA-C-O 120.783 0.243 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.625 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.614 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 52' ' ' SER . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.614 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.645 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.649 0.262 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.7 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.562 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.528 HD22 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.915 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.411 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.664 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.609 HD23 ' H ' ' A' ' 58' ' ' LEU . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.559 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.519 HG11 ' O ' ' A' ' 57' ' ' ARG . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HE ' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.63 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.685 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.47 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.417 ' HA3' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.519 ' O ' HG11 ' A' ' 43' ' ' VAL . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.609 ' H ' HD23 ' A' ' 35' ' ' LEU . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.664 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.915 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.68 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.452 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.452 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.855 0.273 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.426 ' O ' HG23 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.685 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.463 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.715 0.293 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.672 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.403 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.488 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.655 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.446 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.48 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.455 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.751 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.701 HD22 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.655 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.463 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.503 ' C ' ' H ' ' A' ' 49' ' ' SER . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.572 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.503 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.474 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.0 m-20 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.665 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.572 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.701 ' HB2' HD22 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.751 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.55 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.662 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.519 ' HB ' ' HA ' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.672 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 CA-C-O 120.769 0.237 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.432 ' O ' HG21 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.561 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.432 HG21 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.561 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.665 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.461 0.086 0 CA-C-O 120.886 0.374 . . . . 0.0 111.065 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.613 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.566 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.489 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . 0.434 ' C ' ' H ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.659 HD22 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.566 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.559 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.51 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.443 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.707 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.568 ' HA ' HD23 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.659 ' HB2' HD22 ' A' ' 35' ' ' LEU . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.613 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.71 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . 0.406 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo . . . . . 0 N--CA 1.465 -0.203 0 CA-C-O 120.903 0.293 . . . . 0.0 112.118 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.408 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.707 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 . . . . . 0 N--CA 1.458 -0.028 0 CA-C-O 120.924 0.392 . . . . 0.0 110.641 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.749 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.458 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.468 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.67 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.487 ' H ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.524 HG11 ' O ' ' A' ' 57' ' ' ARG . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.432 HG22 ' CA ' ' A' ' 20' ' ' TRP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.489 ' C ' ' H ' ' A' ' 49' ' ' SER . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.451 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.8 m-20 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.449 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.524 ' O ' HG11 ' A' ' 43' ' ' VAL . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.538 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.433 HD22 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.67 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.528 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.51 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.415 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.546 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.731 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.749 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.231 0.151 0 CA-C-O 120.818 0.257 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.51 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.571 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.571 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.449 ' HD3' ' CB ' ' A' ' 53' ' ' TRP . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.494 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.721 0.296 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TRP . . . . . 0.75 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.495 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.544 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.488 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.548 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.413 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.569 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.858 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.54 HD23 ' H ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . 0.725 ' HB3' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.536 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.503 HG23 ' HB2' ' A' ' 58' ' ' LEU . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.494 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.441 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.452 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TRP . . . . . 0.814 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.452 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' HG11 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.725 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.49 ' O ' HD23 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.858 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 21' ' ' ALA . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.568 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.414 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . 0.639 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.75 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' MET . . . . . 0.732 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo . . . . . 0 C--O 1.23 0.081 0 CA-C-O 120.81 0.254 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' ILE . . . . . 0.639 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.418 ' O ' HG21 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' ARG . . . . . 0.424 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' THR . . . . . 0.418 HG21 ' O ' ' B' ' 80' ' ' ASP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.35 98.45 3.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.065 0.459 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.541 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 2.9 m -66.43 128.84 30.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.493 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -157.85 38.19 0.27 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.509 -179.614 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.673 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.417 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.616 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.462 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.411 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.695 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.71 HD23 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.616 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.55 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.471 HG11 ' O ' ' A' ' 57' ' ' ARG . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.493 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.462 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.421 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.453 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.673 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.462 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.608 HH11 HD22 ' A' ' 62' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.71 ' HB2' HD23 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.608 HD22 HH11 ' A' ' 57' ' ' ARG . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.695 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.58 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.674 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.559 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.673 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp -146.16 99.75 3.28 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.42 106.37 6.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 110.949 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.981 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.623 0.249 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.419 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo -66.45 124.38 12.38 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.672 2.248 . . . . 0.0 112.286 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.674 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.52 ' O ' HG21 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.535 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.52 HG21 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.673 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.425 ' H1 ' ' HG3' ' A' ' 74' ' ' MET . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 58.92 90.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.384 0.611 . . . . 0.0 111.273 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.6 m -89.62 133.47 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.774 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.559 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -160.49 48.06 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.653 -179.59 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.695 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.451 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.622 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.441 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.431 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.511 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.431 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.47 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.631 HD23 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.559 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.524 ' N ' HG11 ' A' ' 45' ' ' VAL . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.458 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.448 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.429 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.812 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.458 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HB2' HD23 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.453 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.564 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.651 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.622 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.695 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -155.06 103.37 2.38 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.425 ' HG3' ' H1 ' ' A' ' 16' ' ' GLY . 0.0 OUTLIER -70.24 114.8 8.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 28.9 mtp180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.908 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.612 0.244 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.28 124.44 15.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.633 2.222 . . . . 0.0 112.368 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.651 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.558 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.558 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.812 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.92 39.68 3.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.239 0.542 . . . . 0.0 110.643 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -74.04 109.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.959 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.461 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 -156.3 53.83 0.55 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.682 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.421 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.541 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.486 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.421 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.622 ' HG2' ' HZ3' ' B' ' 84' ' ' LYS . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.472 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.542 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.58 HG23 ' HB2' ' A' ' 58' ' ' LEU . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.469 ' N ' HG11 ' A' ' 43' ' ' VAL . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.461 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.428 ' H ' ' HA3' ' A' ' 56' ' ' GLY . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.426 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.453 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.406 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.56 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.453 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.428 ' HA3' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' HB3' HD21 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.58 ' HB2' HG23 ' A' ' 43' ' ' VAL . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.471 ' CE1' ' HA ' ' A' ' 67' ' ' ALA . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.542 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.471 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.541 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.682 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? -148.37 99.2 3.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.34 106.03 6.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 0.0 111.041 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.876 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.562 0.22 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.24 129.11 23.22 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.633 2.222 . . . . 0.0 111.976 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.57 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.622 ' HZ3' ' HG2' ' A' ' 31' ' ' GLU . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.418 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -123.24 39.82 3.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.232 0.539 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 19.4 t -68.28 93.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.539 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER -157.0 52.65 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.062 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.622 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.563 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.504 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.468 ' HB3' ' O ' ' A' ' 35' ' ' LEU . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.764 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.468 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.549 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.623 HG23 ' HB2' ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.539 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.42 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.449 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.728 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.494 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.474 ' HG1' HD21 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.623 ' HB2' HG23 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.41 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.764 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.549 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.566 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.482 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.563 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -138.87 99.18 3.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 111.89 6.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.961 0.41 . . . . 0.0 111.252 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.6 mtt-85 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.429 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.457 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo -56.33 130.47 40.32 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.708 2.272 . . . . 0.0 112.44 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.566 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.528 ' O ' HG21 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.493 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.528 HG21 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.493 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.435 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -135.18 39.97 2.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.265 0.555 . . . . 0.0 110.679 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.556 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -76.82 96.73 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.962 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -130.82 51.02 2.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.778 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.592 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.472 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.435 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.476 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.484 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.424 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.484 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.683 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.429 HD23 ' H ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.572 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.562 HG23 ' HB2' ' A' ' 58' ' ' LEU . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.425 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.713 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.47 ' HB3' ' HA ' ' A' ' 48' ' ' SER . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.466 ' O ' HG11 ' A' ' 43' ' ' VAL . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.696 HD11 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.423 HD21 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.683 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.426 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.746 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.476 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.592 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.727 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.778 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? -152.73 99.53 2.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mtt -78.94 105.76 10.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.344 . . . . 0.0 110.732 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.935 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.654 0.264 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -69.39 132.99 25.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.68 2.253 . . . . 0.0 112.035 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.746 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.421 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.426 ' HG1' ' HD1' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.436 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.713 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 44.42 2.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.068 0.461 . . . . 0.0 110.695 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.489 HG11 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -73.76 108.25 5.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.936 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.5 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 -152.79 59.3 0.8 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.646 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' HB3' HG23 ' A' ' 70' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.561 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.493 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.493 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.504 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.593 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.695 HD23 ' H ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.59 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.456 HG11 ' N ' ' A' ' 44' ' ' GLU . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.456 ' N ' HG11 ' A' ' 43' ' ' VAL . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.448 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.437 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.509 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.6 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.448 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.408 ' O ' HG11 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.695 ' H ' HD23 ' A' ' 35' ' ' LEU . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.593 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.421 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.59 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.509 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.722 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.404 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.646 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -152.13 133.99 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 8.9 ttt -96.61 109.22 21.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 2.6 mmm180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.98 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.714 0.292 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.404 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo -51.61 127.7 23.57 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.721 2.281 . . . . 0.0 112.818 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.722 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.511 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.441 HG22 ' HB2' ' A' ' 52' ' ' SER . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.511 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.6 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.574 -0.21 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.39 99.66 7.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.999 0.428 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.4 m -89.37 82.77 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.614 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.492 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -126.02 57.67 1.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.218 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.738 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.571 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.436 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.501 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.616 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.54 HD23 ' H ' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.584 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.541 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.421 HG23 ' HB2' ' A' ' 58' ' ' LEU . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.519 HG22 ' CA ' ' A' ' 20' ' ' TRP . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.441 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.48 HD22 ' HA ' ' B' ' 85' ' ' PRO . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.402 ' HG2' ' HG1' ' B' ' 83' ' ' THR . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.574 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.744 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.454 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.54 ' H ' HD23 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.449 ' HA2' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.616 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.511 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.584 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.574 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.702 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.571 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.738 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.692 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp -152.79 99.61 2.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.1 ttp -70.53 106.23 3.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.9 0.381 . . . . 0.0 110.841 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.953 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.628 0.251 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.35 131.54 43.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.594 2.196 . . . . 0.0 112.314 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.702 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.429 HG22 ' HB2' ' A' ' 52' ' ' SER . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HG2' HD11 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.744 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.617 -0.193 . . . . 0.0 112.617 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.6 94.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.324 0.583 . . . . 0.0 111.178 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.7 t -80.09 78.96 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.323 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -137.08 62.88 1.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.753 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.797 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.404 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.601 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.436 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.496 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.473 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.485 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.64 HD23 ' N ' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.578 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.601 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.621 HG23 ' HB2' ' A' ' 58' ' ' LEU . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.501 HG22 ' N ' ' A' ' 20' ' ' TRP . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.454 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.466 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.425 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.427 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.466 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.582 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.64 ' N ' HD23 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.473 ' HA2' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.653 ' HB2' ' HE3' ' A' ' 53' ' ' TRP . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.497 ' HB2' ' HD2' ' A' ' 66' ' ' PRO . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.578 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.431 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.464 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.688 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.797 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? -137.61 99.6 3.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.26 105.75 4.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.371 . . . . 0.0 110.667 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.9 mtp85 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.985 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.573 0.225 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -51.29 127.58 22.6 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.741 2.294 . . . . 0.0 112.764 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.508 HG21 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.515 ' O ' HG21 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.488 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.515 HG21 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.488 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.136 0 N-CA-C 112.591 -0.204 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -130.54 96.63 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.062 0.458 . . . . 0.0 111.241 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -94.5 108.53 20.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.012 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.487 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 -148.84 52.4 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.067 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.679 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.423 ' CB ' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.547 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.486 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.486 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.762 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.428 ' CD1' ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.537 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.547 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.517 HG21 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.476 ' N ' HG11 ' A' ' 43' ' ' VAL . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.487 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.44 ' N ' HG11 ' A' ' 45' ' ' VAL . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.433 ' OG ' HG13 ' A' ' 45' ' ' VAL . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.441 HD22 ' HA ' ' B' ' 85' ' ' PRO . 4.5 m-20 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.615 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.437 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.517 ' HB2' HG21 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.404 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.762 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.427 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.537 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.732 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.474 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.532 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.679 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp -146.88 99.41 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.2 ttt -72.08 106.95 4.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.902 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.537 0.208 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.474 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo -53.37 129.41 33.49 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.513 2.142 . . . . 0.0 112.193 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.732 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.472 ' O ' HG21 ' B' ' 83' ' ' THR . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.497 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.472 HG21 ' O ' ' B' ' 80' ' ' ASP . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.505 ' HG2' HD11 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.615 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 112.408 -0.277 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.424 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.11 39.11 1.7 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.057 0.456 . . . . 0.0 111.072 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.637 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -61.3 104.49 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.692 179.637 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 -136.62 43.13 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.538 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.663 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.525 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.457 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.425 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.517 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.506 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.517 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.483 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.443 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.681 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.509 HD23 ' H ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.707 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.522 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' A' ' 21' ' ' ALA . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.544 HD13 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.457 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.459 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.633 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.459 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA3' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.544 ' HG2' HD13 ' A' ' 46' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.707 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.681 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.468 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.562 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.425 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.525 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.663 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -86.26 99.92 11.9 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.84 110.34 18.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.735 0.302 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.75 101.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.651 2.234 . . . . 0.0 112.137 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.468 HG21 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.521 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.633 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.439 -0.265 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -123.84 97.31 5.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.226 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.527 HG13 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -103.36 91.98 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.851 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.501 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 -138.86 45.44 2.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.083 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.661 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.44 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.617 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.444 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.827 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.402 HD13 ' NH1' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.474 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.781 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.569 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.529 HG11 ' N ' ' A' ' 44' ' ' GLU . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.529 ' N ' HG11 ' A' ' 43' ' ' VAL . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.501 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.463 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.464 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.46 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.597 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.464 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.569 HD11 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.402 ' H ' ' HG ' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.781 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.457 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.827 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.709 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.444 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.617 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.661 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -146.62 99.86 3.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.1 ttp -70.41 108.31 4.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.936 0.398 . . . . 0.0 111.288 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.838 179.796 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.6 0.238 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.92 128.81 30.23 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.508 2.139 . . . . 0.0 112.163 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.709 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.432 ' O ' HG21 ' B' ' 83' ' ' THR . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.508 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -124.97 43.29 3.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.17 0.509 . . . . 0.0 110.84 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.34 72.3 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.917 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.524 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -123.6 58.85 1.13 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.426 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.733 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.551 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.471 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.668 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.411 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.514 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.591 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.405 HD12 ' CB ' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.668 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.513 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.497 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.555 HG12 ' HE1' ' A' ' 73' ' ' MET . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.614 HG23 ' HB2' ' A' ' 58' ' ' LEU . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.524 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.578 HD13 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.528 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.486 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.663 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.528 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.411 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.578 ' HG2' HD13 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.614 ' HB2' HG23 ' A' ' 43' ' ' VAL . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.591 ' N ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.494 ' CE1' HG23 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.483 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.41 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.659 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.471 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.551 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.733 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.661 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? -153.78 100.31 2.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.9 ttm -70.67 105.71 3.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.802 0.334 . . . . 0.0 110.596 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.926 179.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.406 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo -50.2 127.53 20.11 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.814 2.343 . . . . 0.0 112.606 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.659 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.663 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.19 46.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.926 0.393 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.444 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.9 OUTLIER -69.75 104.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.287 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.531 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 -146.25 43.05 1.21 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.682 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.669 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.665 ' HB1' HG23 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.57 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.407 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.625 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.502 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.486 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.607 ' HG3' ' HZ1' ' B' ' 84' ' ' LYS . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.825 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.429 ' O ' ' HB3' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.625 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.53 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.61 HG23 ' HB2' ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.531 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.409 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.614 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.454 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' VAL . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.404 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.444 ' HE2' HD21 ' A' ' 58' ' ' LEU . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.825 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.499 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.783 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.894 HD22 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.407 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.665 HG23 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.669 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -147.41 99.48 3.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 ttt -72.31 108.41 5.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 0.0 110.966 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.951 179.944 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.424 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.663 0.268 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 6.5 Cg_endo -50.93 124.67 14.26 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.918 2.412 . . . . 0.0 112.512 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.894 HG12 HD22 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.472 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.607 ' HZ1' ' HG3' ' A' ' 31' ' ' GLU . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . 0.468 ' H2 ' ' HE3' ' A' ' 74' ' ' MET . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.8 94.45 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.131 0.491 . . . . 0.0 111.041 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.2 122.63 16.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.022 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.52 ' HA ' ' HG ' ' A' ' 48' ' ' SER . 8.4 ptt180 -141.34 51.9 1.57 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.821 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.429 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.463 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.463 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.517 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.587 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.502 HD23 ' HB2' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.591 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.559 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.488 HG11 ' N ' ' A' ' 44' ' ' GLU . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.488 ' N ' HG11 ' A' ' 43' ' ' VAL . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.485 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.505 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.52 ' HG ' ' HA ' ' A' ' 19' ' ' ARG . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.455 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.769 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.492 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.505 ' HB ' ' HB2' ' A' ' 47' ' ' ASP . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 37' ' ' PHE . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.512 ' HB2' HD22 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.587 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.429 ' CE1' ' HB1' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.61 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.764 HD22 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.631 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.499 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.821 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp -145.86 106.74 4.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.468 ' HE3' ' H2 ' ' A' ' 16' ' ' GLY . 28.8 ttm -70.4 105.77 3.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.874 0.369 . . . . 0.0 110.889 -179.483 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.45 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.541 0.21 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.631 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo -53.23 92.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.748 2.299 . . . . 0.0 112.645 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.764 HG12 HD22 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.769 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.686 -0.165 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.3 95.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.261 0.553 . . . . 0.0 111.524 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.39 122.18 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.567 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 -152.47 51.84 0.77 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.196 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.641 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.497 ' O ' ' HB ' ' A' ' 43' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.573 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.455 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HD2' ' HB3' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.51 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.484 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.511 HD23 ' HA ' ' A' ' 57' ' ' ARG . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.72 ' HB3' HD11 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.537 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.497 ' HB ' ' O ' ' A' ' 21' ' ' ALA . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.567 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.543 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.454 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 5.9 m-20 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.541 ' HB2' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.645 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.543 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.511 ' HA ' HD23 ' A' ' 35' ' ' LEU . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.411 ' O ' HD12 ' A' ' 35' ' ' LEU . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.576 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.625 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.455 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.573 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.641 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp -79.94 101.13 8.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.6 ttm -83.75 110.91 18.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.893 0.377 . . . . 0.0 111.015 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.009 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.69 0.281 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.3 127.04 24.22 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.66 2.24 . . . . 0.0 112.336 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.625 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.614 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.541 HG22 ' HB2' ' A' ' 52' ' ' SER . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.614 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.645 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.561 -0.215 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -125.62 100.82 6.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.125 0.488 . . . . 0.0 111.148 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.697 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.8 m -94.92 80.85 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.23 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 -127.77 45.22 2.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.194 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.7 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.424 ' HB1' ' CE1' ' A' ' 65' ' ' PHE . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.562 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.528 HD22 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.413 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.474 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.915 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.411 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.44 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.664 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.609 HD23 ' H ' ' A' ' 58' ' ' LEU . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.559 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.519 HG11 ' O ' ' A' ' 57' ' ' ARG . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.474 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HE ' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.47 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.63 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.685 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.47 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.417 ' HA3' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.519 ' O ' HG11 ' A' ' 43' ' ' VAL . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.609 ' H ' HD23 ' A' ' 35' ' ' LEU . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.43 HD21 ' HB3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.664 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.439 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.915 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB1' ' O ' ' A' ' 52' ' ' SER . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.68 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.452 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp -154.8 120.81 5.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.61 109.97 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.926 0.394 . . . . 0.0 110.894 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.894 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.726 0.298 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.452 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo -54.45 131.16 43.85 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.623 2.215 . . . . 0.0 112.415 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.68 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.426 ' O ' HG23 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.426 HG23 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.685 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.12 92.61 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 0.0 111.139 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 97.1 t -93.43 100.49 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.224 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.463 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 -160.72 60.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.174 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.672 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.403 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.525 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.519 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.488 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.655 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.446 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.455 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.751 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.701 HD22 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.655 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.463 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.503 ' C ' ' H ' ' A' ' 49' ' ' SER . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.572 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.503 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.474 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.0 m-20 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.665 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.572 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.701 ' HB2' HD22 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.751 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.414 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.55 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.662 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.488 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.519 ' HB ' ' HA ' ' A' ' 23' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.672 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp -148.43 99.26 3.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.8 tmm? -72.36 106.27 4.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 110.955 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.98 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . 0.451 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 5.6 Cg_endo -49.82 128.98 22.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.858 2.372 . . . . 0.0 112.145 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.662 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.432 ' O ' HG21 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.561 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.432 HG21 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.561 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.665 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -104.75 92.47 4.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.686 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.6 m -88.71 101.25 11.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.202 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -142.22 45.52 1.65 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.613 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.417 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.566 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.498 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.489 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . 0.434 ' C ' ' H ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.605 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.659 HD22 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.566 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.445 HH11 ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.559 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.444 HG11 ' HA ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.51 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.443 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.428 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.707 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.443 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.568 ' HA ' HD23 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.659 ' HB2' HD22 ' A' ' 35' ' ' LEU . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.613 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.71 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp -148.53 100.18 3.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.73 106.91 4.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.611 0.244 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . 0.406 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo -48.52 104.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.646 2.23 . . . . 0.0 112.118 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.408 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.707 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.64 40.69 3.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.843 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -98.77 71.9 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.753 179.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 -118.87 55.57 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.641 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.749 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.528 ' HB1' ' CZ ' ' A' ' 65' ' ' PHE . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.458 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.468 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.67 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.538 HD23 ' N ' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.487 ' H ' ' HB3' ' A' ' 27' ' ' PHE . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.524 HG11 ' O ' ' A' ' 57' ' ' ARG . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.432 HG22 ' CA ' ' A' ' 20' ' ' TRP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.489 ' C ' ' H ' ' A' ' 49' ' ' SER . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.451 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.8 m-20 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.449 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.524 ' O ' HG11 ' A' ' 43' ' ' VAL . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.538 ' N ' HD23 ' A' ' 35' ' ' LEU . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.433 HD22 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.67 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.528 ' CZ ' ' HB1' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.51 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.415 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.546 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.731 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.749 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER -141.0 99.51 3.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.32 105.55 5.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.4 ptt180 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.947 179.858 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.63 0.252 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.4 127.6 19.43 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.666 2.244 . . . . 0.0 112.297 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.51 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.571 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.571 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.449 ' HD3' ' CB ' ' A' ' 53' ' ' TRP . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.05 35.42 5.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.479 0.657 . . . . 0.0 110.706 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -88.34 106.6 16.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.881 179.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.494 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 -150.25 61.62 0.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TRP . . . . . 0.75 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.495 ' HB2' ' CE1' ' A' ' 65' ' ' PHE . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.544 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.488 ' HB1' HG13 ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.548 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.413 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.548 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.569 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.448 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.858 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.54 HD23 ' H ' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . 0.725 ' HB3' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.536 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.503 HG23 ' HB2' ' A' ' 58' ' ' LEU . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.494 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.441 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.452 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.814 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.452 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.475 ' O ' HG11 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.725 HD12 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.49 ' O ' HD23 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.858 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PHE . . . . . 0.495 ' CE1' ' HB2' ' A' ' 21' ' ' ALA . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.568 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.414 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . 0.639 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' VAL . . . . . 0.544 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.75 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' MET . . . . . 0.732 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? -152.16 103.97 2.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 ttp -74.13 105.93 5.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.784 0.325 . . . . 0.0 110.74 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.467 ' NH1' ' HB2' ' A' ' 75' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.948 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.634 0.254 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.33 129.22 32.94 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.648 2.232 . . . . 0.0 112.208 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' ILE . . . . . 0.639 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.418 ' O ' HG21 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ARG . . . . . 0.424 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' THR . . . . . 0.418 HG21 ' O ' ' B' ' 80' ' ' ASP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' PRO . . . . . 0.814 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.498 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.625 0.25 . . . . 0.0 111.509 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.605 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.706 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.429 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.613 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.539 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.485 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.742 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.807 HD21 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.66 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.498 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.721 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.493 ' HG2' HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.807 ' HB2' HD21 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 58' ' ' LEU . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.742 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 52' ' ' SER . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.679 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.456 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.709 0.212 . . . . 0.0 112.286 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.679 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.547 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.493 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.721 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.636 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.59 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.634 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.518 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.434 HD12 HH11 ' B' ' 81' ' ' ARG . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.6 HG21 ' HD2' ' A' ' 37' ' ' PHE . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.445 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.86 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.838 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.732 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.557 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.665 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.634 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.636 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? . . . . . 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.816 0.257 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.569 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.86 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.466 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.837 0.351 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.78 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.447 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.537 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.489 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.525 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 58' ' ' LEU . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.786 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.61 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.462 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.848 HD22 ' HG2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.545 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.476 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.743 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.625 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.23 0.096 0 CA-C-O 120.849 0.27 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.743 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.583 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.583 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.848 ' HG2' HD22 ' A' ' 64' ' ' LEU . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.546 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.626 0.25 . . . . 0.0 111.062 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.578 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.51 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.489 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.798 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.717 HG22 HD12 ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.407 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.416 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.491 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.765 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.491 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.514 HG23 HD23 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.798 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.547 ' HB3' HG21 ' B' ' 79' ' ' ILE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.584 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.489 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.458 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo . . . . . 0 N--CA 1.467 -0.088 0 CA-C-O 120.903 0.293 . . . . 0.0 112.44 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.531 ' O ' HG22 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.503 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.531 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.765 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.431 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.897 0.38 . . . . 0.0 110.943 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.802 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.878 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.603 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.46 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.495 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.525 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.734 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.406 HD21 ' CB ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.699 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.596 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.468 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.514 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.754 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.514 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.713 HG23 HD23 ' A' ' 64' ' ' LEU . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.647 ' HD3' HD23 ' A' ' 62' ' ' LEU . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.84 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.573 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.769 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.631 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.674 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.802 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 CA-C-O 120.899 0.291 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.769 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.54 ' O ' HG23 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.54 HG23 ' O ' ' B' ' 80' ' ' ASP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.84 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.504 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.918 0.389 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.582 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.65 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.61 HD12 ' NH1' ' B' ' 81' ' ' ARG . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.612 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 ' CB ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.592 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.433 ' H ' ' HA2' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.442 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.493 HG23 HD23 ' A' ' 64' ' ' LEU . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.433 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.427 ' O ' HG13 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.626 HD23 ' HB2' ' A' ' 59' ' ' HIS . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.626 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.681 HD13 ' HD2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.592 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.417 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.626 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.409 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.936 0.307 . . . . 0.0 112.818 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.57 ' O ' HG22 ' B' ' 83' ' ' THR . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.61 ' NH1' HD12 ' A' ' 30' ' ' LEU . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.57 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.681 ' HD2' HD13 ' A' ' 64' ' ' LEU . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.499 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.002 0.43 . . . . 0.0 110.218 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.745 ' HB2' ' H ' ' A' ' 73' ' ' MET . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.643 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.572 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.641 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.519 HG21 ' HD2' ' A' ' 37' ' ' PHE . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.499 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.791 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' HD12 ' A' ' 46' ' ' LEU . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.532 ' HB2' HD23 ' A' ' 58' ' ' LEU . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.459 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.589 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.712 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.643 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.745 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.23 0.093 0 CA-C-O 120.834 0.264 . . . . 0.0 112.314 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.712 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.497 ' O ' HG22 ' B' ' 83' ' ' THR . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.503 ' NH1' HD12 ' A' ' 30' ' ' LEU . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.497 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.791 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.007 0.432 . . . . 0.0 110.753 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.831 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.877 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.877 HD11 ' HB3' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.577 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.877 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.557 HG22 ' HE2' ' A' ' 65' ' ' PHE . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.47 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.687 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.466 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.877 ' HB3' HD11 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.482 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.673 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.437 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.557 HG21 ' HB1' ' A' ' 21' ' ' ALA . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.62 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.831 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.429 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 67.5 Cg_exo . . . . . 0 C--O 1.231 0.143 0 CA-C-O 120.844 0.268 . . . . 0.0 112.764 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.601 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.573 ' O ' HG22 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.498 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.573 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.705 0.288 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.871 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.704 HH21 ' HB3' ' A' ' 71' ' ' ALA . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.569 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.797 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.731 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.886 HG22 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.56 HG23 HD23 ' A' ' 64' ' ' LEU . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.886 ' HB2' HG22 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.494 ' O ' HD13 ' A' ' 35' ' ' LEU . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.797 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.73 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.704 ' HB3' HH21 ' A' ' 22' ' ' ARG . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.615 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.48 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo . . . . . 0 CA--C 1.526 0.092 0 CA-C-O 120.817 0.257 . . . . 0.0 112.193 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.509 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.495 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.584 0.231 . . . . 0.0 111.538 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.442 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.479 HD12 ' HD3' ' B' ' 81' ' ' ARG . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.498 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.758 ' HG2' HD12 ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' CB ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.873 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.883 HG22 HD12 ' A' ' 58' ' ' LEU . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.453 ' H ' HG12 ' A' ' 45' ' ' VAL . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.452 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.68 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.502 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.64 HG23 HD23 ' A' ' 64' ' ' LEU . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.459 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.883 HD12 HG22 ' A' ' 43' ' ' VAL . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.758 HD12 ' HG2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.682 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.833 0.264 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.577 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.537 ' O ' HG22 ' B' ' 83' ' ' THR . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.537 HG22 ' O ' ' B' ' 80' ' ' ASP . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.508 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.657 0.265 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.594 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.794 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.457 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.646 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.846 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.646 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.855 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 36' ' ' GLY . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.42 ' N ' HD12 ' A' ' 35' ' ' LEU . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.794 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.508 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.51 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.482 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.51 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.647 HG23 HD23 ' A' ' 64' ' ' LEU . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' C ' HG13 ' A' ' 43' ' ' VAL . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 35.4 m80 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.855 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.514 ' CE1' HG22 ' A' ' 70' ' ' VAL . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.846 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.232 0.201 0 CA-C-O 120.768 0.236 . . . . 0.0 112.163 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.518 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.482 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.53 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 121.074 0.464 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.712 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.656 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.565 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.528 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.496 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.665 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.603 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.793 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.656 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.53 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD12 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.696 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.519 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.477 HG23 HD23 ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HG2' HD12 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.793 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.468 ' O ' HD23 ' A' ' 35' ' ' LEU . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.605 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HB3' HG21 ' B' ' 79' ' ' ILE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.666 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.581 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.712 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.41 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo . . . . . 0 C--O 1.23 0.085 0 CA-C-O 120.831 0.263 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.54 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 . . . . . 0 N--CA 1.457 -0.082 0 CA-C-O 120.985 0.422 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.598 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.68 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.434 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.62 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.883 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.803 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.687 HG22 HD12 ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.403 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.497 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.653 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.497 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.597 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.883 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.813 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.922 HD21 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.68 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.598 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.846 0.269 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.922 HG12 HD21 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.402 ' HB3' HG23 ' B' ' 83' ' ' THR . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.486 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.402 HG23 ' HB3' ' B' ' 80' ' ' ASP . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.491 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 8.4 ptt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.826 0.346 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.847 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.654 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.57 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.541 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.541 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.461 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.637 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.83 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 38' ' ' ARG . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.583 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 47' ' ' ASP . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.811 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.613 HG23 HD23 ' A' ' 64' ' ' LEU . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.518 ' O ' HG13 ' A' ' 43' ' ' VAL . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.83 ' HB3' HD11 ' A' ' 35' ' ' LEU . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.463 ' HB2' HD23 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.709 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.468 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.632 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.788 HD21 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.665 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.654 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.847 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.665 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo . . . . . 0 N--CA 1.465 -0.157 0 CA-C-O 120.776 0.24 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.788 HG12 HD21 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.514 ' H ' HD13 ' B' ' 79' ' ' ILE . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.421 ' HD3' HD12 ' A' ' 30' ' ' LEU . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.486 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.811 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.573 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.611 0.243 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.573 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.509 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.589 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.47 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.555 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.705 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.49 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.705 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.546 HD11 ' HB3' ' A' ' 58' ' ' LEU . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 57' ' ' ARG . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.573 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.9 OUTLIER 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.69 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.538 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.61 ' O ' HG13 ' A' ' 43' ' ' VAL . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.614 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.905 HD22 ' HG2' ' B' ' 85' ' ' PRO . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.572 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.62 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.589 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 CA--C 1.528 0.195 0 CA-C-O 120.783 0.243 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.62 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.431 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.647 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.647 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.905 ' HG2' HD22 ' A' ' 64' ' ' LEU . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.48 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.649 0.262 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.643 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.83 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.446 HD21 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.943 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.425 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.403 HD12 ' NH1' ' B' ' 81' ' ' ARG . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.693 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 57' ' ' ARG . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.83 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.515 HD13 ' HG2' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.517 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.724 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.517 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.745 HG23 HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.409 ' HA2' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.607 ' HD3' HD23 ' A' ' 62' ' ' LEU . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.584 HD12 HG22 ' A' ' 43' ' ' VAL . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.745 HD23 HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.943 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.684 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.459 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.615 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.855 0.273 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.45 ' O ' HG22 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.471 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.715 0.293 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.616 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.635 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.508 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.559 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.776 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.904 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.654 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.548 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' H ' ' A' ' 47' ' ' ASP . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.5 ' H ' HG12 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.557 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 1.0 OUTLIER 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.71 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.557 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.904 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.551 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.503 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.618 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.616 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 CA-C-O 120.769 0.237 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.677 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.524 ' O ' HG22 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.573 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.524 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.573 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.518 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.461 0.086 0 CA-C-O 120.886 0.374 . . . . 0.0 111.065 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.648 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 38' ' ' ARG . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.655 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.783 HG22 ' HG ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.518 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.447 ' HB3' HG11 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.7 OUTLIER 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.747 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.616 ' HA ' HD22 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.783 ' HG ' HG22 ' A' ' 43' ' ' VAL . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.629 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' ARG . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.648 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo . . . . . 0 N--CA 1.465 -0.203 0 CA-C-O 120.903 0.293 . . . . 0.0 112.118 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.416 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.512 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.747 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 . . . . . 0 N--CA 1.458 -0.028 0 CA-C-O 120.924 0.392 . . . . 0.0 110.641 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.804 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.86 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.524 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.524 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.759 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.875 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.645 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.86 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.671 HG12 ' H ' ' A' ' 47' ' ' ASP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.671 ' H ' HG12 ' A' ' 45' ' ' VAL . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . 0.46 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.494 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 1.1 m120 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.406 ' HB2' ' OG1' ' B' ' 83' ' ' THR . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.465 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.875 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.759 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.522 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.677 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.804 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.231 0.151 0 CA-C-O 120.818 0.257 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.522 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.587 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 52' ' ' SER . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.596 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.5 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.721 0.296 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TRP . . . . . 0.763 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.769 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.485 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.71 ' HB1' ' OE2' ' A' ' 34' ' ' GLU . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.882 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.45 HD21 ' HB3' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.785 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.769 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.435 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.492 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TRP . . . . . 0.862 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.492 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.451 ' C ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.785 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.417 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.882 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.419 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASN . . . . . 0.637 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.697 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' MET . . . . . 0.763 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo . . . . . 0 C--O 1.23 0.081 0 CA-C-O 120.81 0.254 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' ILE . . . . . 0.637 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 81' ' ' ARG . . . . . 0.425 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' THR . . . . . 0.58 HG23 ' HD1' ' A' ' 53' ' ' TRP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 85' ' ' PRO . . . . . 0.862 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.35 98.45 3.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.065 0.459 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.554 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 2.9 m -66.43 128.84 30.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.498 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -157.85 38.19 0.27 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.509 -179.614 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.605 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.706 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.429 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.613 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.539 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.485 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.742 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.807 HD21 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.66 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.498 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.721 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.493 ' HG2' HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.807 ' HB2' HD21 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 58' ' ' LEU . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.742 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 52' ' ' SER . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.679 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp -146.16 99.75 3.28 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.42 106.37 6.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 110.949 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.981 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.623 0.249 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.456 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo -66.45 124.38 12.38 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.672 2.248 . . . . 0.0 112.286 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.679 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.547 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.493 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.721 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 58.92 90.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.384 0.611 . . . . 0.0 111.273 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.6 m -89.62 133.47 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.774 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -160.49 48.06 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.653 -179.59 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.636 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.59 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.634 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.518 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.434 HD12 HH11 ' B' ' 81' ' ' ARG . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.6 HG21 ' HD2' ' A' ' 37' ' ' PHE . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.445 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.86 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.838 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.732 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.557 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.665 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.634 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.636 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -155.06 103.37 2.38 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.24 114.8 8.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.413 ' HD2' HH11 ' A' ' 75' ' ' ARG . 28.9 mtp180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.908 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.612 0.244 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.28 124.44 15.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.633 2.222 . . . . 0.0 112.368 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.569 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.86 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.92 39.68 3.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.239 0.542 . . . . 0.0 110.643 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 18' ' ' VAL . 0.9 OUTLIER -74.04 109.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.959 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.466 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 -156.3 53.83 0.55 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.78 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.447 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.537 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.489 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.525 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 58' ' ' LEU . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.786 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.61 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.462 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.848 HD22 ' HG2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.545 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.476 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.743 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.625 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? -148.37 99.2 3.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.34 106.03 6.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 0.0 111.041 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.876 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.562 0.22 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.24 129.11 23.22 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.633 2.222 . . . . 0.0 111.976 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.743 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.583 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.583 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.848 ' HG2' HD22 ' A' ' 64' ' ' LEU . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -123.24 39.82 3.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.232 0.539 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 19.4 t -68.28 93.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.546 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER -157.0 52.65 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.062 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.578 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.51 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.489 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.798 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.717 HG22 HD12 ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.407 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.416 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.491 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.765 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.491 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.514 HG23 HD23 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.798 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.547 ' HB3' HG21 ' B' ' 79' ' ' ILE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.584 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.489 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -138.87 99.18 3.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 111.89 6.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.961 0.41 . . . . 0.0 111.252 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.6 mtt-85 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.45 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.458 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo -56.33 130.47 40.32 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.708 2.272 . . . . 0.0 112.44 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.531 ' O ' HG22 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.503 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.531 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.765 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.454 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -135.18 39.97 2.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.265 0.555 . . . . 0.0 110.679 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.571 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -76.82 96.73 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.962 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -130.82 51.02 2.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.802 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.878 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.603 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.46 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.495 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.525 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.734 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.406 HD21 ' CB ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.699 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.596 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.468 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.514 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.754 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.514 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.713 HG23 HD23 ' A' ' 64' ' ' LEU . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.647 ' HD3' HD23 ' A' ' 62' ' ' LEU . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.84 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.573 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.769 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.631 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.674 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.802 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? -152.73 99.53 2.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mtt -78.94 105.76 10.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.344 . . . . 0.0 110.732 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.935 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.654 0.264 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -69.39 132.99 25.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.68 2.253 . . . . 0.0 112.035 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.769 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.54 ' O ' HG23 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.54 HG23 ' O ' ' B' ' 80' ' ' ASP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.84 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 44.42 2.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.068 0.461 . . . . 0.0 110.695 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -73.76 108.25 5.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.936 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.504 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 -152.79 59.3 0.8 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.582 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.65 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.61 HD12 ' NH1' ' B' ' 81' ' ' ARG . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.612 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 ' CB ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.592 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.433 ' H ' ' HA2' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.442 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.493 HG23 HD23 ' A' ' 64' ' ' LEU . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.433 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.427 ' O ' HG13 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD23 ' HB2' ' A' ' 59' ' ' HIS . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.626 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.681 HD13 ' HD2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.592 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.417 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.626 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -152.13 133.99 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 8.9 ttt -96.61 109.22 21.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 2.6 mmm180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.98 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.714 0.292 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.409 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo -51.61 127.7 23.57 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.721 2.281 . . . . 0.0 112.818 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.57 ' O ' HG22 ' B' ' 83' ' ' THR . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.61 ' NH1' HD12 ' A' ' 30' ' ' LEU . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.57 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.681 ' HD2' HD13 ' A' ' 64' ' ' LEU . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.574 -0.21 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.39 99.66 7.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.999 0.428 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.4 m -89.37 82.77 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.614 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.499 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -126.02 57.67 1.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.218 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.745 ' HB2' ' H ' ' A' ' 73' ' ' MET . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.643 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.572 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.641 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.519 HG21 ' HD2' ' A' ' 37' ' ' PHE . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.499 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.791 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' HD12 ' A' ' 46' ' ' LEU . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.532 ' HB2' HD23 ' A' ' 58' ' ' LEU . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.459 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.589 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.712 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.643 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.745 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp -152.79 99.61 2.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.1 ttp -70.53 106.23 3.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.9 0.381 . . . . 0.0 110.841 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.953 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.628 0.251 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.35 131.54 43.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.594 2.196 . . . . 0.0 112.314 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.712 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.497 ' O ' HG22 ' B' ' 83' ' ' THR . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.503 ' NH1' HD12 ' A' ' 30' ' ' LEU . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.497 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.791 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.617 -0.193 . . . . 0.0 112.617 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.6 94.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.324 0.583 . . . . 0.0 111.178 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.7 t -80.09 78.96 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.323 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -137.08 62.88 1.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.753 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.831 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.877 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.877 HD11 ' HB3' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.577 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.877 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.557 HG22 ' HE2' ' A' ' 65' ' ' PHE . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.47 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.687 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.466 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.877 ' HB3' HD11 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.673 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.437 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.557 HG21 ' HB1' ' A' ' 21' ' ' ALA . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.62 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.831 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? -137.61 99.6 3.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.26 105.75 4.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.371 . . . . 0.0 110.667 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.9 mtp85 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.985 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.573 0.225 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.429 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 67.5 Cg_exo -51.29 127.58 22.6 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.741 2.294 . . . . 0.0 112.764 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.601 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.573 ' O ' HG22 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.498 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.573 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.136 0 N-CA-C 112.591 -0.204 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -130.54 96.63 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.062 0.458 . . . . 0.0 111.241 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -94.5 108.53 20.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.012 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 -148.84 52.4 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.067 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.871 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.704 HH21 ' HB3' ' A' ' 71' ' ' ALA . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.569 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.797 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.731 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.886 HG22 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.56 HG23 HD23 ' A' ' 64' ' ' LEU . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.886 ' HB2' HG22 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.494 ' O ' HD13 ' A' ' 35' ' ' LEU . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.797 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.73 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.704 ' HB3' HH21 ' A' ' 22' ' ' ARG . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.615 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp -146.88 99.41 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.2 ttt -72.08 106.95 4.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.902 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.537 0.208 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.48 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo -53.37 129.41 33.49 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.513 2.142 . . . . 0.0 112.193 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.509 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 112.408 -0.277 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.11 39.11 1.7 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.057 0.456 . . . . 0.0 111.072 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -61.3 104.49 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.692 179.637 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 -136.62 43.13 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.538 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.442 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.479 HD12 ' HD3' ' B' ' 81' ' ' ARG . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.498 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.758 ' HG2' HD12 ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' CB ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.873 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.883 HG22 HD12 ' A' ' 58' ' ' LEU . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.453 ' H ' HG12 ' A' ' 45' ' ' VAL . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.452 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.68 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.502 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.64 HG23 HD23 ' A' ' 64' ' ' LEU . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.459 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.883 HD12 HG22 ' A' ' 43' ' ' VAL . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.758 HD12 ' HG2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.682 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.643 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -86.26 99.92 11.9 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.84 110.34 18.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.735 0.302 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.75 101.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.651 2.234 . . . . 0.0 112.137 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.577 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.537 ' O ' HG22 ' B' ' 83' ' ' THR . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.537 HG22 ' O ' ' B' ' 80' ' ' ASP . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.439 -0.265 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -123.84 97.31 5.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.226 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -103.36 91.98 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.851 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.508 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 -138.86 45.44 2.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.083 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.594 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.794 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.457 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.646 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.846 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.646 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.855 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 36' ' ' GLY . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.42 ' N ' HD12 ' A' ' 35' ' ' LEU . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.794 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.508 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.51 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.482 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.51 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.647 HG23 HD23 ' A' ' 64' ' ' LEU . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' C ' HG13 ' A' ' 43' ' ' VAL . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 35.4 m80 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.855 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.514 ' CE1' HG22 ' A' ' 70' ' ' VAL . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.846 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -146.62 99.86 3.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.1 ttp -70.41 108.31 4.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.936 0.398 . . . . 0.0 111.288 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.838 179.796 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.6 0.238 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.92 128.81 30.23 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.508 2.139 . . . . 0.0 112.163 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.518 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.482 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -124.97 43.29 3.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.17 0.509 . . . . 0.0 110.84 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.34 72.3 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.917 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -123.6 58.85 1.13 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.426 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.712 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.656 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.565 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.528 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.496 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.665 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.603 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.793 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.656 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.53 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD12 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.696 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.519 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.477 HG23 HD23 ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HG2' HD12 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.793 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.468 ' O ' HD23 ' A' ' 35' ' ' LEU . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.605 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HB3' HG21 ' B' ' 79' ' ' ILE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.666 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.581 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.712 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? -153.78 100.31 2.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.9 ttm -70.67 105.71 3.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.802 0.334 . . . . 0.0 110.596 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.926 179.972 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.41 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo -50.2 127.53 20.11 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.814 2.343 . . . . 0.0 112.606 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.19 46.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.926 0.393 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.453 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.9 OUTLIER -69.75 104.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.287 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.54 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 -146.25 43.05 1.21 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.682 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.598 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.68 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.434 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.62 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.883 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.803 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.687 HG22 HD12 ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.403 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.497 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.653 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.497 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.597 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.883 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.813 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.922 HD21 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.68 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.598 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -147.41 99.48 3.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 ttt -72.31 108.41 5.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 0.0 110.966 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.951 179.944 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.663 0.268 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 6.5 Cg_endo -50.93 124.67 14.26 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.918 2.412 . . . . 0.0 112.512 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.922 HG12 HD21 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.402 ' HB3' HG23 ' B' ' 83' ' ' THR . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.486 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.402 HG23 ' HB3' ' B' ' 80' ' ' ASP . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.8 94.45 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.131 0.491 . . . . 0.0 111.041 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 18' ' ' VAL . 2.1 m -65.2 122.63 16.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.022 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.491 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 8.4 ptt180 -141.34 51.9 1.57 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.847 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.654 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.57 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.541 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.461 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.637 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.83 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 38' ' ' ARG . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.583 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 47' ' ' ASP . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.811 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.613 HG23 HD23 ' A' ' 64' ' ' LEU . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.518 ' O ' HG13 ' A' ' 43' ' ' VAL . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.83 ' HB3' HD11 ' A' ' 35' ' ' LEU . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.463 ' HB2' HD23 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.709 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.468 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.632 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.788 HD21 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.665 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.654 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.847 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp -145.86 106.74 4.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 28.8 ttm -70.4 105.77 3.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.874 0.369 . . . . 0.0 110.889 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.475 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.541 0.21 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.665 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo -53.23 92.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.748 2.299 . . . . 0.0 112.645 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.788 HG12 HD21 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.514 ' H ' HD13 ' B' ' 79' ' ' ILE . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.421 ' HD3' HD12 ' A' ' 30' ' ' LEU . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.486 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.811 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.686 -0.165 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.3 95.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.261 0.553 . . . . 0.0 111.524 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.39 122.18 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.573 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 -152.47 51.84 0.77 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.196 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.573 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.509 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.589 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.47 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.555 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.705 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.49 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.705 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.546 HD11 ' HB3' ' A' ' 58' ' ' LEU . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 57' ' ' ARG . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.573 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.9 OUTLIER 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.69 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.538 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.61 ' O ' HG13 ' A' ' 43' ' ' VAL . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.614 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.905 HD22 ' HG2' ' B' ' 85' ' ' PRO . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.572 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.62 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.589 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp -79.94 101.13 8.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.6 ttm -83.75 110.91 18.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.893 0.377 . . . . 0.0 111.015 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.009 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.69 0.281 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.3 127.04 24.22 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.66 2.24 . . . . 0.0 112.336 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.62 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.431 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.647 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.647 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.905 ' HG2' HD22 ' A' ' 64' ' ' LEU . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.561 -0.215 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.415 ' HD3' HH11 ' A' ' 17' ' ' ARG . 0.0 OUTLIER -125.62 100.82 6.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.125 0.488 . . . . 0.0 111.148 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.699 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.8 m -94.92 80.85 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.23 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.48 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 -127.77 45.22 2.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.194 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.643 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.83 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.446 HD21 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.943 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.425 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.403 HD12 ' NH1' ' B' ' 81' ' ' ARG . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.693 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 57' ' ' ARG . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.83 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.515 HD13 ' HG2' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.517 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.724 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.517 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.745 HG23 HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.409 ' HA2' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.607 ' HD3' HD23 ' A' ' 62' ' ' LEU . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD12 HG22 ' A' ' 43' ' ' VAL . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.745 HD23 HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.943 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.684 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.459 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.615 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.699 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp -154.8 120.81 5.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.61 109.97 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.926 0.394 . . . . 0.0 110.894 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.894 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.726 0.298 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo -54.45 131.16 43.85 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.623 2.215 . . . . 0.0 112.415 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.45 ' O ' HG22 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.12 92.61 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 0.0 111.139 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 97.1 t -93.43 100.49 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.224 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.471 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 -160.72 60.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.174 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.616 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.635 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.508 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.559 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.776 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.904 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.654 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.548 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' H ' ' A' ' 47' ' ' ASP . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.5 ' H ' HG12 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.557 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 1.0 OUTLIER 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.71 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.557 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.904 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.551 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.503 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.618 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.616 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp -148.43 99.26 3.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.8 tmm? -72.36 106.27 4.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 110.955 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.98 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 76' ' ' ALA . . . . . 0.469 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 5.6 Cg_endo -49.82 128.98 22.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.858 2.372 . . . . 0.0 112.145 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.677 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.524 ' O ' HG22 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.573 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.524 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.573 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -104.75 92.47 4.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 -179.832 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.695 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.6 m -88.71 101.25 11.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.202 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.518 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -142.22 45.52 1.65 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.648 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 38' ' ' ARG . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.655 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.783 HG22 ' HG ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.518 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.447 ' HB3' HG11 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 0.7 OUTLIER 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.747 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.616 ' HA ' HD22 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.783 ' HG ' HG22 ' A' ' 43' ' ' VAL . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.629 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' ARG . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.695 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp -148.53 100.18 3.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.73 106.91 4.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.611 0.244 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo -48.52 104.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.646 2.23 . . . . 0.0 112.118 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.416 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.512 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.747 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.64 40.69 3.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.843 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.671 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.1 OUTLIER -98.77 71.9 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.753 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 -118.87 55.57 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.641 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.804 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.86 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.524 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.524 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.759 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.875 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.645 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.86 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.671 HG12 ' H ' ' A' ' 47' ' ' ASP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.671 ' H ' HG12 ' A' ' 45' ' ' VAL . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . 0.46 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.494 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 1.1 m120 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.406 ' HB2' ' OG1' ' B' ' 83' ' ' THR . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.465 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.875 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.759 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.677 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.804 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER -141.0 99.51 3.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.32 105.55 5.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.4 ptt180 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.947 179.858 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.63 0.252 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.4 127.6 19.43 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.666 2.244 . . . . 0.0 112.297 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.522 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.587 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 52' ' ' SER . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.596 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.05 35.42 5.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.479 0.657 . . . . 0.0 110.706 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.488 HG12 ' CB ' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -88.34 106.6 16.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.881 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.5 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 -150.25 61.62 0.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TRP . . . . . 0.763 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.769 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.485 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.71 ' HB1' ' OE2' ' A' ' 34' ' ' GLU . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.882 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.45 HD21 ' HB3' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.785 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.769 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.435 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.492 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.862 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.492 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.451 ' C ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.785 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.417 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.882 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.419 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASN . . . . . 0.637 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.697 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' MET . . . . . 0.763 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? -152.16 103.97 2.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 ttp -74.13 105.93 5.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.784 0.325 . . . . 0.0 110.74 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 75' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.948 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.634 0.254 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.33 129.22 32.94 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.648 2.232 . . . . 0.0 112.208 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' ILE . . . . . 0.637 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ARG . . . . . 0.425 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' THR . . . . . 0.58 HG23 ' HD1' ' A' ' 53' ' ' TRP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 85' ' ' PRO . . . . . 0.862 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.498 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.103 0 CA-C-O 120.625 0.25 . . . . 0.0 111.509 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.605 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.706 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.429 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.613 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.539 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.485 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.742 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.807 HD21 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.66 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.498 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.721 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.493 ' HG2' HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.807 ' HB2' HD21 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 58' ' ' LEU . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.742 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 52' ' ' SER . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.679 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp . . . . . 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.456 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo . . . . . 0 C--O 1.231 0.138 0 CA-C-O 120.709 0.212 . . . . 0.0 112.286 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.679 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.547 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.493 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.721 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.527 0.087 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.636 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.59 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.634 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.518 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.434 HD12 HH11 ' B' ' 81' ' ' ARG . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.6 HG21 ' HD2' ' A' ' 37' ' ' PHE . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.568 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.445 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.86 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.838 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.732 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.557 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.665 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.634 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.636 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? . . . . . 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo . . . . . 0 C--O 1.231 0.144 0 CA-C-O 120.816 0.257 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.569 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.86 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.466 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.837 0.351 . . . . 0.0 111.361 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.78 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.556 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.447 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.537 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.489 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.525 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 58' ' ' LEU . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.786 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.61 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.462 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.848 HD22 ' HG2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.545 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.476 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.743 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.625 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? . . . . . 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.23 0.096 0 CA-C-O 120.849 0.27 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.743 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.583 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.583 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.848 ' HG2' HD22 ' A' ' 64' ' ' LEU . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.546 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.109 0 CA-C-O 120.626 0.25 . . . . 0.0 111.062 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.578 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.51 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.489 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.798 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.717 HG22 HD12 ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.407 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.416 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.491 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.765 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.491 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.514 HG23 HD23 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.798 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.547 ' HB3' HG21 ' B' ' 79' ' ' ILE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.584 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.489 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? . . . . . 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.458 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo . . . . . 0 N--CA 1.467 -0.088 0 CA-C-O 120.903 0.293 . . . . 0.0 112.44 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.531 ' O ' HG22 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.503 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.531 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.765 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.431 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.897 0.38 . . . . 0.0 110.943 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.802 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.878 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.603 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.46 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.495 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.525 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.525 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.734 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.406 HD21 ' CB ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.699 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.596 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.468 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.514 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.754 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.514 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.713 HG23 HD23 ' A' ' 64' ' ' LEU . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.647 ' HD3' HD23 ' A' ' 62' ' ' LEU . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.84 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.573 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.769 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.631 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.674 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.802 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? . . . . . 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.463 -0.266 0 CA-C-O 120.899 0.291 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.769 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.54 ' O ' HG23 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.54 HG23 ' O ' ' B' ' 80' ' ' ASP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.84 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.504 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.918 0.389 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.582 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.65 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.61 HD12 ' NH1' ' B' ' 81' ' ' ARG . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.612 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 ' CB ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.592 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.433 ' H ' ' HA2' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.442 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.493 HG23 HD23 ' A' ' 64' ' ' LEU . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.433 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.427 ' O ' HG13 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.626 HD23 ' HB2' ' A' ' 59' ' ' HIS . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.626 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.681 HD13 ' HD2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.592 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.417 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.626 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? . . . . . 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.409 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.936 0.307 . . . . 0.0 112.818 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.57 ' O ' HG22 ' B' ' 83' ' ' THR . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.61 ' NH1' HD12 ' A' ' 30' ' ' LEU . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.57 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.681 ' HD2' HD13 ' A' ' 64' ' ' LEU . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.499 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 121.002 0.43 . . . . 0.0 110.218 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.745 ' HB2' ' H ' ' A' ' 73' ' ' MET . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.643 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.572 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.416 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.641 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.589 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.519 HG21 ' HD2' ' A' ' 37' ' ' PHE . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.499 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.496 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.791 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' HD12 ' A' ' 46' ' ' LEU . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.532 ' HB2' HD23 ' A' ' 58' ' ' LEU . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.459 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.589 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.712 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.643 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.745 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp . . . . . 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 C--O 1.23 0.093 0 CA-C-O 120.834 0.264 . . . . 0.0 112.314 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.712 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.497 ' O ' HG22 ' B' ' 83' ' ' THR . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.503 ' NH1' HD12 ' A' ' 30' ' ' LEU . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.497 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.791 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 121.007 0.432 . . . . 0.0 110.753 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.831 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.877 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.877 HD11 ' HB3' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.577 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.877 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.557 HG22 ' HE2' ' A' ' 65' ' ' PHE . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.47 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.687 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.466 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.877 ' HB3' HD11 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.482 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.673 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.437 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.429 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.557 HG21 ' HB1' ' A' ' 21' ' ' ALA . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.62 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.831 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.429 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 67.5 Cg_exo . . . . . 0 C--O 1.231 0.143 0 CA-C-O 120.844 0.268 . . . . 0.0 112.764 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.601 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.573 ' O ' HG22 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.498 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.573 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 . . . . . 0 N--CA 1.457 -0.076 0 CA-C-O 120.705 0.288 . . . . 0.0 111.067 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.871 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.704 HH21 ' HB3' ' A' ' 71' ' ' ALA . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.569 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.797 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.731 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.886 HG22 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.5 m-20 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.56 HG23 HD23 ' A' ' 64' ' ' LEU . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.886 ' HB2' HG22 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.494 ' O ' HD13 ' A' ' 35' ' ' LEU . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.797 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.73 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.704 ' HB3' HH21 ' A' ' 22' ' ' ARG . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.615 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.48 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo . . . . . 0 CA--C 1.526 0.092 0 CA-C-O 120.817 0.257 . . . . 0.0 112.193 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.509 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.495 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.584 0.231 . . . . 0.0 111.538 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.546 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.442 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.479 HD12 ' HD3' ' B' ' 81' ' ' ARG . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.498 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.758 ' HG2' HD12 ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' CB ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.873 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.883 HG22 HD12 ' A' ' 58' ' ' LEU . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.453 ' H ' HG12 ' A' ' 45' ' ' VAL . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.452 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.68 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.502 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.64 HG23 HD23 ' A' ' 64' ' ' LEU . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.459 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.883 HD12 HG22 ' A' ' 43' ' ' VAL . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.758 HD12 ' HG2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.682 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.592 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? . . . . . 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 C--O 1.23 0.12 0 CA-C-O 120.833 0.264 . . . . 0.0 112.137 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.577 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.537 ' O ' HG22 ' B' ' 83' ' ' THR . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.537 HG22 ' O ' ' B' ' 80' ' ' ASP . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.508 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 . . . . . 0 N--CA 1.458 -0.066 0 CA-C-O 120.657 0.265 . . . . 0.0 111.083 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.594 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.794 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.457 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.646 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.846 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.646 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.855 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 36' ' ' GLY . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.42 ' N ' HD12 ' A' ' 35' ' ' LEU . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.794 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.508 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.51 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.482 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.51 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.647 HG23 HD23 ' A' ' 64' ' ' LEU . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' C ' HG13 ' A' ' 43' ' ' VAL . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.855 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.514 ' CE1' HG22 ' A' ' 70' ' ' VAL . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.846 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.232 0.201 0 CA-C-O 120.768 0.236 . . . . 0.0 112.163 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.518 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.482 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.53 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 121.074 0.464 . . . . 0.0 110.426 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.712 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.656 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.565 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.528 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.496 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.665 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.603 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.793 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.656 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.53 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.505 HD12 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.696 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.519 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.477 HG23 HD23 ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HG2' HD12 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.793 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.468 ' O ' HD23 ' A' ' 35' ' ' LEU . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.605 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HB3' HG21 ' B' ' 79' ' ' ILE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.666 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.581 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.712 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? . . . . . 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.41 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo . . . . . 0 C--O 1.23 0.085 0 CA-C-O 120.831 0.263 . . . . 0.0 112.606 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.54 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 . . . . . 0 N--CA 1.457 -0.082 0 CA-C-O 120.985 0.422 . . . . 0.0 110.682 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.598 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.68 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.434 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.62 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.883 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.803 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.687 HG22 HD12 ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.403 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.497 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.653 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.497 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.597 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.883 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.813 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.922 HD21 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.68 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.598 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo . . . . . 0 N--CA 1.464 -0.218 0 CA-C-O 120.846 0.269 . . . . 0.0 112.512 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.922 HG12 HD21 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.402 ' HB3' HG23 ' B' ' 83' ' ' THR . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.486 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.402 HG23 ' HB3' ' B' ' 80' ' ' ASP . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.491 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 8.4 ptt180 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.826 0.346 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.847 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.654 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.57 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.541 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.541 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.461 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.637 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.83 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 38' ' ' ARG . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.583 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 47' ' ' ASP . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.811 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.613 HG23 HD23 ' A' ' 64' ' ' LEU . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.518 ' O ' HG13 ' A' ' 43' ' ' VAL . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.83 ' HB3' HD11 ' A' ' 35' ' ' LEU . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.463 ' HB2' HD23 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.709 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.468 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.632 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.788 HD21 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.665 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.654 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.847 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp . . . . . 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.665 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo . . . . . 0 N--CA 1.465 -0.157 0 CA-C-O 120.776 0.24 . . . . 0.0 112.645 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.788 HG12 HD21 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.514 ' H ' HD13 ' B' ' 79' ' ' ILE . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.421 ' HD3' HD12 ' A' ' 30' ' ' LEU . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.486 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.811 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.573 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.611 0.243 . . . . 0.0 111.196 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.573 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.509 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.589 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.47 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.555 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.705 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.49 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.705 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.546 HD11 ' HB3' ' A' ' 58' ' ' LEU . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 57' ' ' ARG . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.573 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 5.9 m-20 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.69 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.538 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.61 ' O ' HG13 ' A' ' 43' ' ' VAL . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.614 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.905 HD22 ' HG2' ' B' ' 85' ' ' PRO . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.572 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.62 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.589 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo . . . . . 0 CA--C 1.528 0.195 0 CA-C-O 120.783 0.243 . . . . 0.0 112.336 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.62 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.431 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.647 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.647 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.905 ' HG2' HD22 ' A' ' 64' ' ' LEU . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.48 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 . . . . . 0 CA--C 1.527 0.091 0 CA-C-O 120.649 0.262 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.643 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.83 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.446 HD21 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.943 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.425 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.403 HD12 ' NH1' ' B' ' 81' ' ' ARG . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.693 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 57' ' ' ARG . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.83 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.515 HD13 ' HG2' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.517 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.724 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.517 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.745 HG23 HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.409 ' HA2' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.607 ' HD3' HD23 ' A' ' 62' ' ' LEU . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.584 HD12 HG22 ' A' ' 43' ' ' VAL . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.745 HD23 HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.943 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.684 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.459 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.615 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.643 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo . . . . . 0 C--O 1.232 0.183 0 CA-C-O 120.855 0.273 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.45 ' O ' HG22 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.471 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 . . . . . 0 CA--C 1.529 0.135 0 CA-C-O 120.715 0.293 . . . . 0.0 111.174 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.616 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.635 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.508 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.559 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.776 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.904 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.654 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.548 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' H ' ' A' ' 47' ' ' ASP . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.5 ' H ' HG12 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.557 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.0 m-20 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.71 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.557 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.904 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.551 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.503 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.618 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.616 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo . . . . . 0 N--CA 1.463 -0.298 0 CA-C-O 120.769 0.237 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.677 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.524 ' O ' HG22 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.573 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.524 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.573 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.518 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.461 0.086 0 CA-C-O 120.886 0.374 . . . . 0.0 111.065 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.648 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.629 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 38' ' ' ARG . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.655 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.783 HG22 ' HG ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.518 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.447 ' HB3' HG11 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.747 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.616 ' HA ' HD22 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.783 ' HG ' HG22 ' A' ' 43' ' ' VAL . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.629 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' ARG . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.648 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp . . . . . 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo . . . . . 0 N--CA 1.465 -0.203 0 CA-C-O 120.903 0.293 . . . . 0.0 112.118 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.416 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.512 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.747 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 . . . . . 0 N--CA 1.458 -0.028 0 CA-C-O 120.924 0.392 . . . . 0.0 110.641 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.804 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.86 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.524 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.524 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.759 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.875 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.645 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.86 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.671 HG12 ' H ' ' A' ' 47' ' ' ASP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.671 ' H ' HG12 ' A' ' 45' ' ' VAL . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . 0.46 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.494 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.8 m-20 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.406 ' HB2' ' OG1' ' B' ' 83' ' ' THR . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.465 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.875 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.759 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.522 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.677 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.804 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo . . . . . 0 C--O 1.231 0.151 0 CA-C-O 120.818 0.257 . . . . 0.0 112.297 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.522 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.587 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 52' ' ' SER . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.596 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.5 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.721 0.296 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TRP . . . . . 0.763 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.769 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.485 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.71 ' HB1' ' OE2' ' A' ' 34' ' ' GLU . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.882 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.45 HD21 ' HB3' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.785 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.769 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.435 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.492 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TRP . . . . . 0.862 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.492 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.451 ' C ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.785 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.417 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.882 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PHE . . . . . 0.478 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.419 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.637 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.697 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' MET . . . . . 0.763 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo . . . . . 0 C--O 1.23 0.081 0 CA-C-O 120.81 0.254 . . . . 0.0 112.208 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' ILE . . . . . 0.637 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' ARG . . . . . 0.425 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' THR . . . . . 0.58 HG23 ' HD1' ' A' ' 53' ' ' TRP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' PRO . . . . . 0.862 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.197 0 N-CA-C 112.51 -0.236 . . . . 0.0 112.51 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.35 98.45 3.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.065 0.459 . . . . 0.0 111.253 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.554 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 2.9 m -66.43 128.84 30.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 179.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.498 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -157.85 38.19 0.27 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.509 -179.614 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.605 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.9 m95 -140.94 156.76 46.01 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.395 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.706 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.17 104.43 8.51 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 120.707 0.289 . . . . 0.0 110.477 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.2 ttt180 -104.38 109.41 21.26 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.63 118.86 21.85 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.388 -178.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -88.44 -17.49 30.32 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 178.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.429 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.8 m-85 -137.03 178.21 7.26 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.303 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -51.46 -176.78 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.458 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.613 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.9 p90 -101.73 146.64 27.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 112.192 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.31 10.14 42.0 Favored 'General case' 0 N--CA 1.462 0.145 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.631 -179.999 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.539 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.68 103.16 2.05 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.994 0.426 . . . . 0.0 111.017 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.1 mt -104.82 -13.38 15.88 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.449 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.485 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 6.5 mm-40 -95.5 170.47 9.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.008 179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.91 -34.27 20.98 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.9 179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.64 8.32 4.56 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.813 179.842 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.742 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.8 mt-10 -105.81 -176.51 3.1 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.218 0.533 . . . . 0.0 111.543 -179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.807 HD21 ' HB2' ' A' ' 58' ' ' LEU . 2.9 tp -134.87 139.66 45.19 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.023 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.59 132.05 9.89 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.314 -0.946 . . . . 0.0 113.872 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.66 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -116.22 -179.96 3.82 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.505 -0.347 . . . . 0.0 110.085 178.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.41 174.64 9.67 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.541 179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 88.4 p -50.15 136.07 19.98 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.584 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.43 58.65 12.24 Favored Glycine 0 C--N 1.331 0.254 0 CA-C-N 115.783 -0.644 . . . . 0.0 113.158 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.574 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 35.9 mm-40 -127.45 149.92 49.88 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.894 0.378 . . . . 0.0 111.499 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 58.3 t -110.77 130.61 63.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.806 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.706 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 38.4 t -129.1 142.55 43.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.388 -179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -94.0 112.8 24.68 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.165 179.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.498 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.7 t -80.39 137.63 21.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.907 0.384 . . . . 0.0 111.155 -179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.493 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.62 -23.57 13.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.144 -179.749 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.46 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -152.68 93.39 1.76 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.887 0.375 . . . . 0.0 111.546 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.418 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p -85.6 5.83 29.98 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.668 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.1 m -78.15 113.78 16.42 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.296 -0.961 . . . . 0.0 108.567 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 159.84 155.78 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 114.575 -1.193 . . . . 0.0 108.797 -179.112 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -91.88 12.5 2.15 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.08 1.853 . . . . 0.0 113.712 -179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 1.0 OUTLIER -170.84 -64.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.357 0.502 . . . . 0.0 112.357 179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.721 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -96.85 119.54 35.52 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.5 m0 -110.66 148.15 32.84 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.469 178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 87.1 m -91.7 118.91 31.08 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.906 179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -142.49 -166.83 11.16 Favored Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.139 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.493 ' HG2' HD12 ' A' ' 46' ' ' LEU . 0.7 OUTLIER -151.41 135.38 16.57 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.046 0.45 . . . . 0.0 111.8 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.807 ' HB2' HD21 ' A' ' 35' ' ' LEU . 9.4 tt -99.37 114.21 26.98 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.974 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 58' ' ' LEU . 4.9 m-70 64.91 -84.54 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.542 -179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -137.58 7.4 2.79 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -100.95 129.27 46.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.937 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.9 134.54 46.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.053 0.454 . . . . 0.0 111.551 -179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 177.2 162.4 27.47 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.579 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.742 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -78.05 155.85 30.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.619 0.247 . . . . 0.0 110.778 -179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.473 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 3.1 p90 -143.65 160.97 48.87 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.664 0.268 . . . . 0.0 111.461 -179.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 76.1 Cg_endo -80.08 106.08 1.87 Allowed 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.751 2.301 . . . . 0.0 112.355 179.432 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 52' ' ' SER . . . -67.45 -10.8 54.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.814 0.34 . . . . 0.0 110.852 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.679 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.84 -34.21 16.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.657 179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.456 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 0.8 OUTLIER -72.74 -41.32 65.28 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.934 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.8 157.31 28.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.22 -179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.46 150.64 61.46 Favored Pre-proline 0 N--CA 1.463 0.178 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.593 -179.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 48.1 Cg_exo -57.95 -178.55 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.862 2.375 . . . . 0.0 113.869 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.3 ttp -146.16 99.75 3.28 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.443 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -75.42 106.37 6.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 110.949 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 7.7 ptm180 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.199 -0.905 . . . . 0.0 110.981 179.892 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.285 0 CA-C-O 120.623 0.249 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.456 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 18.7 Cg_exo -66.45 124.38 12.38 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.672 2.248 . . . . 0.0 112.286 -179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -107.29 122.33 46.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.109 0.48 . . . . 0.0 110.976 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.679 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.34 136.73 51.18 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.27 -179.661 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.0 OUTLIER -108.7 125.16 51.6 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.527 179.788 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.547 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 24.8 mtm-85 -74.43 -5.61 43.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.29 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.2 p -75.75 2.66 11.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.51 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.493 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.0 t -129.4 26.25 5.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.858 0.361 . . . . 0.0 111.401 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 6.9 mtpt -56.62 160.25 5.77 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.921 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.721 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 83.1 Cg_exo -46.48 99.68 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.753 0 C-N-CA 122.569 2.179 . . . . 0.0 112.607 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.166 -0.921 . . . . 0.0 111.043 179.965 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.182 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.2 mtm180 58.92 90.98 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.384 0.611 . . . . 0.0 111.273 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.6 m -89.62 133.47 31.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.774 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -160.49 48.06 0.24 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.653 -179.59 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.636 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 65.5 m95 -139.35 157.03 46.59 Favored 'General case' 0 CA--C 1.52 -0.18 0 CA-C-O 120.666 0.269 . . . . 0.0 110.556 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.59 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.8 104.28 8.87 Favored 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.634 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 7.9 ttt180 -104.41 109.07 20.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.429 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -76.9 120.78 22.5 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.018 -0.992 . . . . 0.0 112.177 -178.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.1 mt -91.16 -20.5 21.92 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 178.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -138.37 178.92 6.77 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.317 -1.311 . . . . 0.0 109.086 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.65 178.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.238 0.542 . . . . 0.0 111.733 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.518 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 44.5 p90 -101.2 146.58 27.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.128 -0.487 . . . . 0.0 112.172 -178.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.433 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.8 OUTLIER -97.4 9.53 42.1 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.332 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.37 103.56 2.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.905 0.383 . . . . 0.0 110.956 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.434 HD12 HH11 ' B' ' 81' ' ' ARG . 0.4 OUTLIER -111.74 -7.66 14.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.572 179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.401 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 4.4 mm-40 -95.0 170.7 9.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.206 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -80.66 -37.81 30.23 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.123 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -85.32 21.13 1.8 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.016 0.436 . . . . 0.0 110.451 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.3 OUTLIER -112.87 163.9 14.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.126 -179.61 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -119.69 138.42 53.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.968 -0.56 . . . . 0.0 109.966 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.2 131.59 9.83 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.481 -0.866 . . . . 0.0 113.396 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -114.14 -176.3 2.87 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-O 120.811 0.338 . . . . 0.0 110.524 179.27 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 16.0 mtm180 -129.52 168.88 15.71 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.81 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 47.0 t -52.67 139.12 27.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.042 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.13 60.68 8.51 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.846 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.565 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 34.7 mm-40 -135.32 149.3 49.73 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.849 0.357 . . . . 0.0 111.367 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 59.0 t -109.39 131.49 60.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.025 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.6 HG21 ' HD2' ' A' ' 37' ' ' PHE . 49.4 t -130.02 143.89 39.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.064 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.09 112.25 24.14 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 179.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.568 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 78.2 t -80.16 139.09 18.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.273 -0.422 . . . . 0.0 111.123 -179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mt -101.56 -27.8 12.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.234 -179.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 23.9 m-20 -148.41 93.14 2.11 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.822 0.344 . . . . 0.0 111.402 -179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.445 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -85.61 1.07 50.68 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 179.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.85 113.82 16.11 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 119.109 -1.036 . . . . 0.0 108.365 178.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 163.45 161.32 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 114.612 -1.176 . . . . 0.0 108.727 -179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -93.58 4.34 3.07 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.016 1.811 . . . . 0.0 114.494 -178.578 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.39 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.86 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 40.9 m95 -111.11 114.54 27.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.3 m0 -109.35 148.85 30.39 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.774 0.321 . . . . 0.0 110.742 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 6.6 m -89.06 118.57 28.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.08 179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.57 177.19 21.39 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.237 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 ptt180 -141.82 134.11 27.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.093 0.473 . . . . 0.0 111.719 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.838 ' HB2' HD21 ' A' ' 35' ' ' LEU . 6.4 tt -99.34 114.66 27.67 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.153 179.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.2 m170 65.53 -84.93 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.697 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -137.5 6.31 2.74 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 111.256 179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 13.3 mtpt -101.46 128.05 47.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.986 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.71 140.52 36.88 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.897 0.379 . . . . 0.0 111.11 -179.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.6 149.95 7.05 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.715 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.732 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -65.98 154.45 39.39 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.592 0.234 . . . . 0.0 110.823 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.15 162.6 44.67 Favored Pre-proline 0 CA--C 1.531 0.233 0 CA-C-N 116.638 -0.255 . . . . 0.0 111.325 -179.588 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.557 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.4 Cg_endo -80.24 107.1 1.99 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.876 2.384 . . . . 0.0 112.5 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.68 -12.88 61.93 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.89 0.376 . . . . 0.0 110.847 179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.665 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.93 -29.23 19.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.0 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.35 27.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.125 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.634 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -122.58 158.3 26.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-O 120.682 0.277 . . . . 0.0 111.338 -179.765 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -124.42 153.27 69.17 Favored Pre-proline 0 N--CA 1.465 0.303 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.883 -179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.636 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.7 Cg_exo -60.61 -178.55 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 123.066 2.511 . . . . 0.0 114.06 -179.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 8.0 tmm? -155.06 103.37 2.38 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.653 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.24 114.8 8.73 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.841 0.353 . . . . 0.0 110.773 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.413 ' HD2' HH11 ' A' ' 75' ' ' ARG . 28.9 mtp180 . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.908 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 120.612 0.244 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -58.28 124.44 15.89 Favored 'Trans proline' 0 C--N 1.346 0.411 0 C-N-CA 122.633 2.222 . . . . 0.0 112.368 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.8 t -97.63 125.24 42.28 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.162 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.665 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.22 136.13 52.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.242 -179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -101.84 117.93 35.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.571 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.569 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 4.3 mtm-85 -67.84 -5.11 14.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.45 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 63.3 m -83.32 4.0 29.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.783 0.325 . . . . 0.0 110.885 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 1.7 p -120.53 21.6 11.53 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.789 -179.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.569 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.6 mtpt -58.98 154.98 35.44 Favored Pre-proline 0 C--N 1.33 -0.242 0 CA-C-N 116.552 -0.295 . . . . 0.0 110.76 179.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.86 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 84.2 Cg_exo -45.65 103.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.668 0 C-N-CA 122.582 2.188 . . . . 0.0 112.524 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.059 -179.986 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.171 0 N-CA-C 112.545 -0.222 . . . . 0.0 112.545 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.92 39.68 3.43 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.239 0.542 . . . . 0.0 110.643 -179.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.44 HG22 ' H ' ' A' ' 18' ' ' VAL . 0.9 OUTLIER -74.04 109.49 6.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.959 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.466 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 5.7 ptm180 -156.3 53.83 0.55 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.361 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.3 m95 -140.24 157.21 45.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.078 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.78 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -125.0 103.92 8.29 Favored 'General case' 0 N--CA 1.444 -0.739 0 C-N-CA 120.758 -0.377 . . . . 0.0 110.46 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.556 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 14.3 ttt180 -105.78 108.92 20.69 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.391 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.447 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -74.43 129.42 37.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.115 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.6 mt -99.86 -21.52 15.69 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.3 178.13 7.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 114.5 -1.227 . . . . 0.0 109.086 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.55 -178.79 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.173 0.511 . . . . 0.0 111.337 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.537 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 35.7 p90 -101.93 147.07 26.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 0.0 112.182 -178.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.422 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -99.98 9.28 43.16 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.433 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.489 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.37 103.21 2.35 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.957 0.408 . . . . 0.0 111.368 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.0 OUTLIER -108.3 -11.84 15.15 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.154 179.425 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -95.84 160.2 14.6 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.062 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -79.94 -21.86 43.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.17 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.525 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -81.92 -0.33 43.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.188 -179.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 29.5 mt-10 -110.92 -168.56 1.32 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.183 0.516 . . . . 0.0 111.537 -179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' HB3' ' A' ' 58' ' ' LEU . 12.5 tp -141.97 142.35 32.97 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.109 -179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.6 134.45 11.86 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.305 -0.95 . . . . 0.0 113.987 -179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.786 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.65 -174.01 2.54 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.944 0.402 . . . . 0.0 110.687 179.156 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.5 mtt85 -129.49 169.34 15.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.852 179.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 t -51.59 144.25 10.95 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.12 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 60.56 7.94 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.681 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.542 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.1 mt-10 -136.55 124.35 22.58 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.821 0.343 . . . . 0.0 111.443 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 t -86.7 134.17 28.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.903 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.78 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 76.6 t -130.51 144.19 38.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.348 -179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -93.57 118.03 30.84 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.6 t -79.56 130.77 35.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.155 0.503 . . . . 0.0 111.261 -178.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.469 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -90.85 -20.69 22.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.95 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -166.15 96.15 0.59 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.414 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -79.7 2.49 22.51 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.707 179.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.9 t -75.29 113.76 13.04 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.578 178.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 160.18 161.81 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.737 -179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 77.4 Cg_endo -89.49 -7.22 4.95 Favored 'Trans proline' 0 N--CA 1.457 -0.657 0 C-N-CA 122.02 1.813 . . . . 0.0 114.452 -178.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -164.84 -41.98 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.335 -0.546 . . . . 0.0 112.309 -179.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.61 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 46.1 m95 -105.46 112.97 26.28 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.415 -179.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 28.6 m0 -108.82 147.18 32.48 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.849 0.356 . . . . 0.0 110.539 179.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 18.0 m -86.69 116.95 25.13 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.158 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.462 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.53 -172.84 13.1 Favored Glycine 0 C--N 1.33 0.227 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.163 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.558 ' O ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -147.93 133.36 18.61 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.042 0.449 . . . . 0.0 111.882 -179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.786 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.2 tt -100.35 120.41 39.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.776 179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 9.9 m-70 64.18 -90.14 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 -178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -135.0 3.78 3.2 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.645 0.259 . . . . 0.0 111.291 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.0 mtpp -97.42 131.96 43.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.097 179.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -102.72 150.25 23.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.927 0.394 . . . . 0.0 111.088 -179.474 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 158.89 152.69 6.52 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.843 -0.694 . . . . 0.0 112.553 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.848 HD22 ' HG2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -63.84 167.66 5.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.804 0.335 . . . . 0.0 111.042 -179.803 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.506 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.4 p90 -155.13 160.25 31.06 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.887 -179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.545 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 67.5 Cg_endo -80.8 103.27 1.46 Allowed 'Trans proline' 0 C--N 1.349 0.59 0 C-N-CA 122.506 2.137 . . . . 0.0 112.365 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.476 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -63.67 -10.92 21.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.745 0.307 . . . . 0.0 111.262 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.743 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.56 -31.46 16.7 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.823 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.99 -40.52 60.64 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.683 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.588 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.73 158.92 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.843 179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -125.68 152.09 71.66 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.616 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.625 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 31.5 Cg_exo -60.75 -178.53 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 122.734 2.289 . . . . 0.0 113.401 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 6.4 tmm? -148.37 99.2 3.0 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.29 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -75.34 106.03 6.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.879 0.371 . . . . 0.0 111.041 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.876 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.562 0.22 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.24 129.11 23.22 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.633 2.222 . . . . 0.0 111.976 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -103.55 123.56 47.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.032 0.444 . . . . 0.0 111.294 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.743 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.49 134.65 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.84 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -96.57 118.85 33.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.034 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.583 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 10.3 mtm-85 -69.53 -5.61 25.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.061 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -83.71 3.47 32.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.473 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 3.2 p -115.7 12.4 15.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.511 -179.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.583 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 7.3 mtpt -54.57 152.57 12.14 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.865 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.848 ' HG2' HD22 ' A' ' 64' ' ' LEU . 90.4 Cg_exo -43.24 100.41 0.03 OUTLIER 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.74 2.293 . . . . 0.0 112.74 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.284 -0.865 . . . . 0.0 111.155 179.964 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.428 -0.269 . . . . 0.0 112.428 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -123.24 39.82 3.86 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.232 0.539 . . . . 0.0 110.545 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 19.4 t -68.28 93.31 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.096 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.546 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.2 OUTLIER -157.0 52.65 0.5 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.062 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.545 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 69.2 m95 -141.77 156.68 45.57 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.732 -179.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.697 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -122.46 104.1 9.16 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.578 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.0 ttm180 -103.66 109.25 20.87 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.51 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.86 122.15 26.29 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.121 -0.945 . . . . 0.0 112.432 -178.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -91.82 -15.78 27.72 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 177.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.489 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -139.37 178.23 7.35 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.321 -1.309 . . . . 0.0 109.351 179.527 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -51.16 -176.38 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 121.297 0.57 . . . . 0.0 111.821 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.51 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 38.8 p90 -101.44 146.99 26.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.929 -179.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.43 11.77 38.7 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.373 179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.62 103.42 2.52 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.018 0.437 . . . . 0.0 111.331 -179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.3 mt -105.4 -9.47 17.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.571 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -104.09 152.32 22.22 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.018 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.4 pm0 -70.07 -26.69 64.12 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.924 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.85 -0.89 36.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.606 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.798 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 79.5 mt-10 -105.2 175.36 5.52 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.139 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -123.39 139.98 53.47 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.579 179.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.28 127.43 7.75 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.324 -0.941 . . . . 0.0 113.427 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -112.78 -173.67 2.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.002 0.43 . . . . 0.0 110.804 179.453 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -129.62 170.5 13.7 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.801 179.469 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.8 t -57.43 147.1 27.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.799 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.33 50.61 55.66 Favored Glycine 0 C--N 1.331 0.28 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.563 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 4.9 mm-40 -129.0 148.54 50.97 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.947 0.403 . . . . 0.0 111.515 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 12.0 t -108.4 135.61 46.64 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.859 179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.717 HG22 HD12 ' A' ' 58' ' ' LEU . 50.6 t -130.43 140.1 49.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.356 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.407 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 40.3 tt0 -90.25 110.17 21.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 179.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.546 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.8 t -79.88 138.41 19.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.904 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mt -109.67 -19.75 13.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.399 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.486 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -149.55 86.65 1.47 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.872 0.368 . . . . 0.0 111.612 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.416 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -81.26 -0.42 40.69 Favored 'General case' 0 CA--C 1.511 -0.545 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.787 179.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.96 113.59 12.44 Favored 'General case' 0 N--CA 1.443 -0.81 0 C-N-CA 119.183 -1.007 . . . . 0.0 108.593 178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.491 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 160.08 158.54 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.719 -179.037 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -91.82 2.37 4.21 Favored 'Trans proline' 0 N--CA 1.455 -0.781 0 C-N-CA 122.008 1.806 . . . . 0.0 114.443 -178.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.61 -38.33 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.765 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 33.9 m95 -114.08 113.59 24.95 Favored 'General case' 0 C--N 1.329 -0.307 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.786 -179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.491 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 13.1 m0 -110.12 142.35 41.73 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.558 -0.292 . . . . 0.0 110.51 178.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.514 HG23 HD23 ' A' ' 64' ' ' LEU . 4.9 m -86.64 116.53 24.82 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.041 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.85 -179.52 18.32 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.875 179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -139.94 133.06 29.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.071 0.462 . . . . 0.0 112.007 -179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 43' ' ' VAL . 5.4 tt -99.74 116.66 32.35 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.948 179.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.7 m-70 65.66 -84.86 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.393 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -139.95 11.18 2.42 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.905 0.384 . . . . 0.0 110.868 179.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpt -104.84 125.65 51.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.058 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.6 146.99 27.74 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.919 0.39 . . . . 0.0 111.504 -179.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.35 167.67 25.24 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.765 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.798 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.46 148.24 30.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.71 0.29 . . . . 0.0 110.74 -179.967 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.432 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 3.3 p90 -136.64 161.92 59.06 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.373 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.547 ' HB3' HG21 ' B' ' 79' ' ' ILE . 65.7 Cg_endo -80.75 107.18 1.92 Allowed 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.766 2.31 . . . . 0.0 112.419 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.72 -16.65 64.39 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.769 0.319 . . . . 0.0 111.292 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.584 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -85.75 -32.1 22.05 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.844 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.489 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 1.0 OUTLIER -73.9 -42.38 60.75 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.193 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.578 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.9 OUTLIER -123.02 152.02 27.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-O 120.99 0.424 . . . . 0.0 111.746 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.82 150.59 46.06 Favored Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.242 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.545 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.2 Cg_exo -63.07 -178.95 0.47 Allowed 'Trans proline' 0 C--N 1.349 0.601 0 C-N-CA 122.787 2.324 . . . . 0.0 114.328 -178.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.4 tmm? -138.87 99.18 3.72 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 114.308 -1.314 . . . . 0.0 109.608 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.84 111.89 6.62 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.961 0.41 . . . . 0.0 111.252 -179.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.6 mtt-85 . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.021 179.922 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.45 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.295 0 CA-C-O 120.724 0.297 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.458 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 13.9 Cg_endo -56.33 130.47 40.32 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.708 2.272 . . . . 0.0 112.44 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 22.9 t -113.58 122.94 48.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.938 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.584 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.17 139.14 42.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.253 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.531 ' O ' HG22 ' B' ' 83' ' ' THR . 0.9 OUTLIER -107.24 126.76 52.83 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.389 179.621 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.503 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 3.6 mtm-85 -71.38 -5.77 35.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.199 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.03 2.37 8.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.404 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.531 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.6 t -129.27 26.15 5.44 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 120.703 0.287 . . . . 0.0 111.679 -179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.503 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -61.13 162.87 11.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.705 179.631 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.765 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 82.1 Cg_exo -45.85 101.66 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 122.392 2.061 . . . . 0.0 112.482 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.116 -179.869 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.194 0 N-CA-C 112.423 -0.271 . . . . 0.0 112.423 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.454 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -135.18 39.97 2.89 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.265 0.555 . . . . 0.0 110.679 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.571 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -76.82 96.73 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.962 179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -130.82 51.02 2.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.802 ' HB2' ' H ' ' A' ' 73' ' ' MET . 84.9 m95 -142.59 156.8 45.13 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.194 -179.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.878 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.36 104.64 7.61 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 120.727 0.299 . . . . 0.0 110.458 -179.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.603 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.7 ttt85 -105.55 109.46 21.43 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 178.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.46 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -73.39 120.43 18.99 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 114.952 -1.022 . . . . 0.0 112.607 -178.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.447 ' HB2' ' CE1' ' A' ' 25' ' ' TYR . 5.4 mt -97.54 -14.66 20.92 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.495 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 1.2 m-85 -139.42 178.24 7.35 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 114.029 -1.441 . . . . 0.0 108.945 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.52 -172.0 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.088 0.47 . . . . 0.0 111.304 179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.525 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 26.4 p90 -102.25 146.87 27.38 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.011 0.434 . . . . 0.0 112.015 -179.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.429 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -102.48 12.27 36.73 Favored 'General case' 0 N--CA 1.461 0.12 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.673 -179.943 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.525 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 102.53 1.96 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.67 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.5 mt -99.37 -13.44 19.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.315 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -102.27 171.75 7.29 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.952 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -90.17 -23.49 21.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.674 179.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -82.06 6.95 14.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.848 179.813 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.734 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 55.4 mt-10 -109.85 -169.48 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.202 -179.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.406 HD21 ' CB ' ' A' ' 58' ' ' LEU . 6.5 tp -136.44 139.87 42.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.422 -179.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.36 130.73 9.15 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.547 -0.835 . . . . 0.0 113.515 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.699 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -116.59 -175.37 2.75 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 179.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 38' ' ' ARG . 6.5 mtm-85 -129.57 165.54 21.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.596 178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -48.78 142.88 5.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.552 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.18 62.1 6.72 Favored Glycine 0 CA--C 1.518 0.231 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.49 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.596 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 1.5 mt-10 -137.03 161.7 35.36 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.752 0.31 . . . . 0.0 111.268 179.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.9 t -122.15 135.5 62.07 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.879 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 57.6 t -130.83 141.42 46.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.346 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -93.35 112.1 23.93 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.431 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 64.7 t -79.83 129.09 38.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.951 0.405 . . . . 0.0 111.317 -179.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -101.63 -12.42 18.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.859 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -151.62 77.76 1.24 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.354 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.468 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 1.3 p -78.73 -2.98 41.95 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.825 179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -73.8 113.64 11.18 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.514 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 162.09 165.29 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.365 0 CA-C-N 114.786 -1.097 . . . . 0.0 108.881 -179.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -92.84 -7.68 2.64 Favored 'Trans proline' 0 N--CA 1.455 -0.753 0 C-N-CA 122.105 1.87 . . . . 0.0 114.424 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -165.75 -33.92 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.754 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.9 m95 -111.57 113.23 25.5 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.959 -0.296 . . . . 0.0 111.352 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.514 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -110.99 141.56 44.29 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.766 0.317 . . . . 0.0 110.549 178.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.713 HG23 HD23 ' A' ' 64' ' ' LEU . 1.7 m -86.33 116.47 24.52 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.052 179.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -143.18 -178.49 19.06 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.959 179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.647 ' HD3' HD23 ' A' ' 62' ' ' LEU . 20.1 ptt180 -138.67 133.46 32.36 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.121 0.486 . . . . 0.0 111.835 -179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.699 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.5 tt -99.17 115.0 28.06 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.243 179.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 65.87 -81.78 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.944 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 59.3 m-20 -141.02 10.46 2.17 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.73 0.3 . . . . 0.0 111.377 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -111.57 126.88 55.47 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.125 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.647 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.19 152.68 21.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.069 0.461 . . . . 0.0 111.464 -179.171 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 160.24 164.14 14.81 Favored Glycine 0 N--CA 1.448 -0.502 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.663 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.84 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.24 146.98 46.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.606 0.241 . . . . 0.0 110.969 -179.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.484 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.0 p90 -137.22 159.36 69.99 Favored Pre-proline 0 C--O 1.233 0.202 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.277 -179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.573 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 87.8 Cg_endo -78.61 106.42 2.11 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.734 2.289 . . . . 0.0 112.469 179.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.35 -9.49 48.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.858 0.361 . . . . 0.0 110.807 179.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.769 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.94 -30.78 15.2 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.864 179.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.495 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -76.46 -39.58 52.9 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.103 -179.894 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.631 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.3 m -122.21 152.51 26.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.864 0.364 . . . . 0.0 111.307 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -111.08 149.13 40.04 Favored Pre-proline 0 C--O 1.231 0.127 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.179 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.674 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.2 Cg_exo -56.35 -179.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.594 2.196 . . . . 0.0 113.862 -179.175 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.802 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.4 tmm? -152.73 99.53 2.45 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.74 -1.118 . . . . 0.0 110.347 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mtt -78.94 105.76 10.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.823 0.344 . . . . 0.0 110.732 -179.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.935 179.998 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 120.654 0.264 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo -69.39 132.99 25.11 Favored 'Trans proline' 0 C--N 1.346 0.438 0 C-N-CA 122.68 2.253 . . . . 0.0 112.035 179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -115.01 128.87 56.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.152 0.501 . . . . 0.0 111.049 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.769 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -108.86 135.09 48.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.184 -179.528 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.54 ' O ' HG23 ' B' ' 83' ' ' THR . 2.1 m-20 -93.73 131.93 38.59 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.2 OUTLIER -77.27 -5.37 49.14 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.211 -179.971 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.49 3.45 36.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.368 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.54 HG23 ' O ' ' B' ' 80' ' ' ASP . 0.1 OUTLIER -116.75 6.88 13.31 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.475 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.446 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -49.78 153.83 1.99 Allowed Pre-proline 0 N--CA 1.464 0.227 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.144 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.84 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -47.15 102.96 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 122.615 2.21 . . . . 0.0 112.665 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.14 -0.933 . . . . 0.0 110.991 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.259 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.63 44.42 2.22 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.068 0.461 . . . . 0.0 110.695 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.543 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -73.76 108.25 5.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.936 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.504 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 9.7 ptt-85 -152.79 59.3 0.8 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.22 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.582 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 72.4 m95 -140.77 156.64 46.12 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.412 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.65 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -124.16 103.93 8.55 Favored 'General case' 0 N--CA 1.444 -0.765 0 CA-C-O 120.742 0.306 . . . . 0.0 110.302 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 2.4 ttt180 -105.1 108.79 20.5 Favored 'General case' 0 N--CA 1.451 -0.42 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.75 123.23 23.72 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.1 -0.955 . . . . 0.0 112.15 -178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.403 ' H ' ' HG ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -95.27 -20.21 19.36 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.467 -0.938 . . . . 0.0 108.467 178.177 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -137.25 178.3 7.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.155 179.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -51.24 -179.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.177 0.513 . . . . 0.0 111.431 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 33.5 p90 -101.39 146.84 27.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.187 -0.461 . . . . 0.0 112.114 -179.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.81 10.95 40.45 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.592 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.563 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.85 102.73 2.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.05 0.452 . . . . 0.0 110.977 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.61 HD12 ' NH1' ' B' ' 81' ' ' ARG . 4.5 mt -105.02 -12.46 16.15 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.216 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.517 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 15.6 mm-40 -95.15 176.53 6.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.973 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -95.12 -24.93 16.64 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.091 -179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.24 1.36 41.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.735 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.612 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.2 mt-10 -103.14 -169.32 1.63 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.357 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.466 HD21 ' CB ' ' A' ' 58' ' ' LEU . 22.1 tp -139.65 139.91 36.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.41 -179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.87 129.19 8.65 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.471 -0.871 . . . . 0.0 113.84 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.592 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -117.87 -175.55 2.86 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.934 0.397 . . . . 0.0 110.596 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -129.82 171.56 12.58 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.915 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.9 t -53.93 145.25 16.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.023 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.69 54.98 29.7 Favored Glycine 0 N--CA 1.451 -0.315 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.016 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.533 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 15.7 mm-40 -132.77 127.12 33.93 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.894 0.378 . . . . 0.0 111.755 -179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.3 t -89.56 132.86 33.21 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.86 179.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.65 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 64.6 t -131.06 144.13 38.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.492 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -93.55 120.08 33.38 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.504 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 44.4 t -79.83 136.46 23.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.977 0.417 . . . . 0.0 111.151 -179.185 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.433 ' H ' ' HA2' ' A' ' 56' ' ' GLY . 0.4 OUTLIER -102.63 -15.51 16.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.949 -179.889 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 10.8 t70 -162.49 85.94 0.58 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.904 0.383 . . . . 0.0 111.393 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.442 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -79.34 0.09 30.45 Favored 'General case' 0 CA--C 1.51 -0.583 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.726 179.456 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 63.3 m -77.27 113.55 15.15 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.176 -1.01 . . . . 0.0 108.388 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.4 m-20 161.26 158.99 0.04 OUTLIER Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 114.664 -1.153 . . . . 0.0 108.789 -179.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -91.34 7.62 3.39 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 122.12 1.88 . . . . 0.0 113.844 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -172.24 -57.75 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 37.0 m95 -96.98 115.16 26.94 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 111.893 0.331 . . . . 0.0 111.893 -178.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 30.5 m0 -109.52 143.18 39.52 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.622 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.493 HG23 HD23 ' A' ' 64' ' ' LEU . 19.2 m -85.91 116.74 24.33 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.997 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.433 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.68 -169.66 11.82 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.294 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.427 ' O ' HG13 ' A' ' 43' ' ' VAL . 20.1 ptt180 -151.08 134.86 16.48 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.042 0.449 . . . . 0.0 111.894 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.626 HD23 ' HB2' ' A' ' 59' ' ' HIS . 9.4 tt -99.51 116.22 31.15 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.904 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.626 ' HB2' HD23 ' A' ' 58' ' ' LEU . 0.8 OUTLIER 64.54 -87.38 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.343 -179.415 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -134.88 3.28 3.2 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.314 179.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 37.0 mtpt -98.11 130.51 44.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.357 -0.383 . . . . 0.0 109.989 179.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 152.03 21.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.023 0.439 . . . . 0.0 111.424 -179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 157.52 155.08 7.35 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 120.965 -0.636 . . . . 0.0 112.569 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.681 HD13 ' HD2' ' B' ' 85' ' ' PRO . 1.0 OUTLIER -67.98 163.2 22.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.632 0.253 . . . . 0.0 110.898 -179.918 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.461 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.9 p90 -151.21 160.91 31.19 Favored Pre-proline 0 C--N 1.33 -0.241 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.407 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.592 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 64.8 Cg_endo -80.27 106.71 1.93 Allowed 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.754 2.303 . . . . 0.0 112.283 179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.417 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.19 -8.14 36.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.833 0.349 . . . . 0.0 110.73 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.07 -33.91 13.89 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.819 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -73.71 -37.47 65.15 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.673 -179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.626 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.72 155.42 28.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 120.85 0.357 . . . . 0.0 111.282 179.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.411 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -119.16 147.74 43.51 Favored Pre-proline 0 N--CA 1.462 0.149 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.435 -179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.582 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.5 Cg_exo -58.5 -177.73 0.11 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 122.939 2.426 . . . . 0.0 113.939 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 tmm? -152.13 133.99 14.85 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.561 -1.199 . . . . 0.0 110.088 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 8.9 ttt -96.61 109.22 21.87 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.902 0.382 . . . . 0.0 111.141 -179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.4 ' H ' ' HG2' ' A' ' 75' ' ' ARG . 2.6 mmm180 . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.98 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 CA-C-O 120.714 0.292 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.409 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 74.8 Cg_exo -51.61 127.7 23.57 Favored 'Trans proline' 0 C--N 1.347 0.489 0 C-N-CA 122.721 2.281 . . . . 0.0 112.818 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -114.49 115.41 27.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.547 179.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.36 137.33 35.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.349 -179.418 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.57 ' O ' HG22 ' B' ' 83' ' ' THR . 12.1 m-20 -101.48 121.32 41.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.748 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.61 ' NH1' HD12 ' A' ' 30' ' ' LEU . 40.5 mtm-85 -75.87 -5.58 46.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.247 -179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 21.3 p -81.14 3.75 22.46 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.431 -179.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.57 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.8 t -126.65 26.35 6.28 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.809 0.338 . . . . 0.0 111.758 -179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.525 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 1.9 mtpp -58.3 161.69 7.15 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.773 179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.681 ' HD2' HD13 ' A' ' 64' ' ' LEU . 83.6 Cg_exo -45.28 99.94 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.788 0 C-N-CA 122.628 2.219 . . . . 0.0 112.746 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.245 -0.883 . . . . 0.0 111.129 179.891 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.574 -0.21 . . . . 0.0 112.574 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.39 99.66 7.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.999 0.428 . . . . 0.0 110.86 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 4.4 m -89.37 82.77 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.614 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.499 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -126.02 57.67 1.37 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.218 179.404 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.745 ' HB2' ' H ' ' A' ' 73' ' ' MET . 74.8 m95 -139.97 156.92 46.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.514 -179.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.643 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -130.97 104.36 7.08 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 120.775 0.321 . . . . 0.0 110.451 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 6.1 ttp180 -105.38 109.35 21.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -78.03 118.58 20.44 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.365 -178.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.0 mt -92.34 -17.53 24.56 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 177.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -133.37 177.65 7.52 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 114.223 -1.353 . . . . 0.0 109.232 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.41 178.76 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.006 0.431 . . . . 0.0 111.335 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.572 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 39.4 p90 -102.13 146.71 27.56 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -178.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -98.09 8.17 45.19 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.281 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.416 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.04 102.88 2.13 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.982 0.42 . . . . 0.0 111.147 -179.478 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.0 mt -107.76 -14.48 14.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.2 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.32 168.47 11.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.958 179.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . 0.455 ' HG2' ' H ' ' A' ' 32' ' ' GLU . 2.0 pt-20 -84.83 -29.19 25.54 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.893 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.77 2.47 19.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.756 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.641 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 76.8 mt-10 -106.26 -175.32 2.76 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.318 -179.602 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.591 HD11 ' HB3' ' A' ' 58' ' ' LEU . 6.1 tp -136.89 138.99 41.29 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.03 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.8 133.95 11.51 Favored Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.36 -0.924 . . . . 0.0 113.677 -179.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.589 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -119.89 -177.72 3.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.991 0.424 . . . . 0.0 110.81 179.23 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.8 mtm180 -129.57 165.94 20.71 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.558 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.8 t -52.32 144.76 12.24 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.77 0.319 . . . . 0.0 110.979 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 57.9 51.88 55.55 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.097 -0.573 . . . . 0.0 112.958 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 67.7 mm-40 -136.83 131.43 33.25 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.904 0.383 . . . . 0.0 111.662 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.2 t -94.36 135.64 28.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.095 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.519 HG21 ' HD2' ' A' ' 37' ' ' PHE . 60.9 t -131.04 144.42 37.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.346 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -93.76 111.65 23.37 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.499 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 93.4 t -80.29 138.08 20.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-O 120.924 0.392 . . . . 0.0 111.215 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.496 HD12 ' HG2' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -96.0 -19.14 19.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.14 -179.821 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.1 m-20 -160.51 101.74 1.35 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.93 0.395 . . . . 0.0 111.549 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.419 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.2 m -88.65 3.14 51.7 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.689 179.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.4 t -75.84 113.67 13.58 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 119.244 -0.983 . . . . 0.0 108.445 178.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.9 m-20 162.08 161.11 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.541 -1.209 . . . . 0.0 108.631 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -92.94 1.83 3.61 Favored 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.07 1.847 . . . . 0.0 114.358 -178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.16 -41.53 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.791 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 20.2 m95 -110.66 113.55 26.25 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.997 -0.281 . . . . 0.0 111.647 -179.02 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.498 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 26.8 m0 -108.73 148.35 30.61 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-O 120.808 0.337 . . . . 0.0 110.91 179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 49.5 m -89.65 124.29 34.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.983 179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -150.49 174.55 29.83 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.002 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' HG2' HD12 ' A' ' 46' ' ' LEU . 6.2 ptt180 -134.04 133.13 40.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 117.326 0.563 . . . . 0.0 112.114 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.591 ' HB3' HD11 ' A' ' 35' ' ' LEU . 8.5 tt -99.62 115.97 30.64 Favored 'General case' 0 C--N 1.334 -0.084 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.161 179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.532 ' HB2' HD23 ' A' ' 58' ' ' LEU . 6.1 m-70 64.67 -82.2 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.746 -179.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -140.76 9.3 2.18 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.743 0.306 . . . . 0.0 111.308 179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.1 mtpt -107.12 126.7 52.71 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.903 179.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.32 145.66 29.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.92 0.39 . . . . 0.0 111.416 -179.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.459 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 164.5 158.9 10.58 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.948 179.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.71 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.4 OUTLIER -66.09 165.09 14.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.71 0.291 . . . . 0.0 111.295 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 5.1 p90 -154.25 162.62 26.48 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.109 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.589 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 53.7 Cg_endo -81.76 104.9 1.48 Allowed 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.831 2.354 . . . . 0.0 112.393 179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.402 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -67.54 -8.14 31.61 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.682 0.277 . . . . 0.0 111.351 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.712 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.64 -29.04 16.32 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.048 -179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.05 -36.92 27.19 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.534 -0.303 . . . . 0.0 110.989 -179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.643 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -122.47 152.34 26.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.769 0.319 . . . . 0.0 111.229 179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -115.66 151.05 45.78 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.281 -179.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 47.0 Cg_exo -57.59 -179.83 0.12 Allowed 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.568 2.179 . . . . 0.0 113.757 -179.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.745 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.6 ttp -152.79 99.61 2.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.786 -1.097 . . . . 0.0 110.101 -179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.1 ttp -70.53 106.23 3.38 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.9 0.381 . . . . 0.0 110.841 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.9 mtp-105 . . . . . 0 C--O 1.248 1.001 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.91 179.953 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.628 0.251 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -53.35 131.54 43.9 Favored 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.594 2.196 . . . . 0.0 112.314 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 7.9 t -110.39 116.09 30.82 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.02 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.712 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.36 136.07 53.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.293 -179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.497 ' O ' HG22 ' B' ' 83' ' ' THR . 0.4 OUTLIER -112.43 125.25 54.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.669 179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.503 ' NH1' HD12 ' A' ' 30' ' ' LEU . 49.3 mtm-85 -72.71 -5.77 39.98 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.116 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 36.2 m -73.02 -1.97 19.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.379 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.497 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.5 t -126.84 26.4 6.19 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.919 0.39 . . . . 0.0 111.167 -179.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.523 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.4 OUTLIER -59.73 161.15 12.16 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.979 179.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.791 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 92.7 Cg_exo -44.59 128.01 8.17 Favored 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.716 2.277 . . . . 0.0 112.997 -179.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.219 -0.896 . . . . 0.0 111.009 179.946 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.617 -0.193 . . . . 0.0 112.617 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 60.6 94.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.324 0.583 . . . . 0.0 111.178 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.7 t -80.09 78.96 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.162 -0.926 . . . . 0.0 111.323 -179.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.464 ' HB2' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -137.08 62.88 1.58 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.753 179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.831 ' HB2' ' H ' ' A' ' 73' ' ' MET . 88.1 m95 -143.12 157.21 44.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.278 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.877 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.82 104.79 7.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 120.776 0.322 . . . . 0.0 110.714 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.631 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.5 ttt85 -105.5 109.7 21.77 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 178.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.421 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.41 134.41 38.42 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.073 -0.967 . . . . 0.0 112.422 -178.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -110.16 -17.91 13.44 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -136.36 177.93 7.46 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 113.949 -1.478 . . . . 0.0 108.745 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -52.78 -178.63 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.005 0.431 . . . . 0.0 111.427 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 43.8 p90 -101.33 146.87 27.0 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -178.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.1 mm-40 -95.69 10.28 37.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.885 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.65 103.3 2.08 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 -179.562 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 4.3 mt -106.45 -11.36 15.96 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.704 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.418 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.3 OUTLIER -104.04 176.63 5.09 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.049 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -89.45 -33.28 16.86 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.031 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -76.31 6.48 5.5 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.965 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.499 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 77.9 mt-10 -107.51 -169.72 1.58 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.063 -179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.877 HD11 ' HB3' ' A' ' 58' ' ' LEU . 1.7 tp -141.61 139.75 33.16 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.29 -179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -114.66 130.44 9.23 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.781 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.577 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.88 -178.11 3.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.958 0.409 . . . . 0.0 110.704 179.083 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.2 mtm180 -129.42 161.81 29.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.295 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.7 p -47.28 145.02 2.51 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.946 0.403 . . . . 0.0 111.379 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.28 61.36 7.55 Favored Glycine 0 N--CA 1.452 -0.27 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.928 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.631 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 2.3 mt-10 -140.31 161.74 36.96 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.742 0.306 . . . . 0.0 111.248 179.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 t -121.95 135.32 62.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.877 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 16.2 t -130.11 138.27 54.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.534 -179.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -91.52 115.18 27.83 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.557 HG22 ' HE2' ' A' ' 65' ' ' PHE . 85.4 t -79.61 136.0 24.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-O 121.048 0.452 . . . . 0.0 111.218 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.47 ' CD1' ' HG2' ' A' ' 57' ' ' ARG . 0.3 OUTLIER -100.36 -22.52 15.04 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.15 -179.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -149.24 77.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.93 0.395 . . . . 0.0 111.339 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -71.09 -6.68 41.01 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.783 179.521 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.07 113.79 10.51 Favored 'General case' 0 N--CA 1.442 -0.829 0 C-N-CA 119.103 -1.039 . . . . 0.0 108.493 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.466 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.7 m-20 161.55 156.18 0.04 OUTLIER Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 114.609 -1.178 . . . . 0.0 108.771 -179.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_endo -90.12 10.15 3.1 Favored 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 122.021 1.814 . . . . 0.0 113.948 -178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -172.28 -60.39 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.687 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 30.4 m95 -97.18 119.28 35.39 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.466 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -113.44 138.97 49.33 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.362 178.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 64' ' ' LEU . 13.5 m -85.65 118.4 25.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.36 179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.38 -167.61 12.91 Favored Glycine 0 CA--C 1.52 0.363 0 N-CA-C 111.835 -0.506 . . . . 0.0 111.835 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' HG2' ' CD1' ' A' ' 46' ' ' LEU . 12.4 ptt180 -145.2 133.88 22.19 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 117.409 0.604 . . . . 0.0 112.008 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.877 ' HB3' HD11 ' A' ' 35' ' ' LEU . 5.0 tp -102.73 117.02 33.74 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.083 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 3.5 m-70 65.26 -85.39 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.267 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -139.06 8.65 2.51 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.234 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.4 mttm -101.85 129.02 47.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.294 -0.412 . . . . 0.0 109.98 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.71 146.42 28.25 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.998 0.428 . . . . 0.0 111.247 -179.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.482 ' HA3' ' C ' ' A' ' 34' ' ' GLU . . . 153.37 156.96 7.83 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.737 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.673 HD13 ' HD2' ' B' ' 85' ' ' PRO . 0.0 OUTLIER -70.25 163.16 27.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.8 0.333 . . . . 0.0 111.092 -179.867 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.607 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 10.4 p90 -147.54 166.36 16.22 Favored Pre-proline 0 CA--C 1.532 0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.047 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.577 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 58.0 Cg_endo -81.97 105.17 1.48 Allowed 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 122.714 2.276 . . . . 0.0 112.338 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.46 -7.8 28.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.855 0.359 . . . . 0.0 110.723 179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.437 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -93.47 -34.06 13.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.013 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.429 ' HA ' ' HB2' ' B' ' 77' ' ' PRO . 1.2 t80 -73.48 -38.52 65.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.244 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.557 HG21 ' HB1' ' A' ' 21' ' ' ALA . 3.0 m -122.37 149.23 25.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.973 0.416 . . . . 0.0 111.642 -179.569 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -103.23 143.48 26.69 Favored Pre-proline 0 C--N 1.332 -0.182 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.697 -179.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.62 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 53.6 Cg_exo -54.57 178.88 0.07 OUTLIER 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.483 2.122 . . . . 0.0 113.856 -179.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.831 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 1.5 tmm? -137.61 99.6 3.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.789 -1.096 . . . . 0.0 110.533 -179.378 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.26 105.75 4.16 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.878 0.371 . . . . 0.0 110.667 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.9 mtp85 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.985 -179.972 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.573 0.225 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.429 ' HB2' ' HA ' ' A' ' 69' ' ' TYR . 67.5 Cg_exo -51.29 127.58 22.6 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.741 2.294 . . . . 0.0 112.764 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 9.0 t -115.12 119.29 35.9 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.568 179.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.601 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -113.88 135.58 53.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.433 -179.391 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.573 ' O ' HG22 ' B' ' 83' ' ' THR . 2.9 m-20 -111.31 134.72 52.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.88 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.498 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 1.6 mtm105 -70.66 -5.57 30.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.394 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.7 p -76.94 3.08 12.94 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.493 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.573 HG22 ' O ' ' B' ' 80' ' ' ASP . 8.9 t -129.2 26.31 5.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.039 0.447 . . . . 0.0 111.396 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.498 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -65.06 162.88 34.94 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.61 179.604 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.687 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 70.9 Cg_exo -49.3 112.19 0.62 Allowed 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 122.37 2.047 . . . . 0.0 112.528 -179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.325 -0.845 . . . . 0.0 111.12 179.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.136 0 N-CA-C 112.591 -0.204 . . . . 0.0 112.591 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -130.54 96.63 4.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.062 0.458 . . . . 0.0 111.241 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -94.5 108.53 20.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.012 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.49 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 19.5 ptt180 -148.84 52.4 0.98 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.18 -0.463 . . . . 0.0 111.067 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.615 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.6 m95 -140.59 156.98 46.12 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.537 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.871 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -123.74 104.09 8.78 Favored 'General case' 0 N--CA 1.444 -0.727 0 CA-C-O 120.75 0.309 . . . . 0.0 110.209 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.704 HH21 ' HB3' ' A' ' 71' ' ' ALA . 14.0 ttp180 -104.0 109.29 21.01 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.51 138.7 40.41 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.158 -0.928 . . . . 0.0 112.008 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 15.5 mt -114.25 -11.43 12.6 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -141.5 177.86 7.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 113.926 -1.488 . . . . 0.0 108.77 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -53.46 -176.73 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.108 0.48 . . . . 0.0 111.312 179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.569 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 36.1 p90 -101.02 146.61 27.2 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.961 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.405 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -99.29 11.58 38.68 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.679 -179.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.569 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.01 2.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.997 0.427 . . . . 0.0 111.012 -179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.5 mt -110.26 -3.57 16.17 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.668 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -109.3 164.86 12.08 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.113 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -75.06 -39.37 60.96 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.917 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.41 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 5.1 t0 -71.65 -4.84 29.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.519 179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.797 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 73.9 mt-10 -102.32 158.62 16.06 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.995 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.731 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -116.41 144.42 44.31 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.264 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.05 134.11 11.42 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.233 -0.984 . . . . 0.0 113.827 -179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.696 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.01 -169.08 1.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.813 0.34 . . . . 0.0 110.393 179.055 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.2 mtt85 -129.68 163.72 25.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.236 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.1 t -55.0 128.06 31.87 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.028 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.75 59.62 4.69 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.877 179.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.561 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 58.9 mm-40 -141.52 145.98 35.83 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.927 0.394 . . . . 0.0 111.377 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.8 t -99.34 137.6 26.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.887 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.886 HG22 ' HB2' ' A' ' 58' ' ' LEU . 45.1 t -130.51 143.65 40.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.191 -179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -94.4 112.02 23.78 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.49 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 97.1 t -79.79 138.8 19.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.046 -179.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.8 -28.21 11.3 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.312 -179.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -145.83 85.16 1.68 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.916 0.389 . . . . 0.0 111.489 -179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.7 OUTLIER -75.86 -0.62 21.88 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.574 179.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.99 113.55 14.82 Favored 'General case' 0 N--CA 1.443 -0.793 0 C-N-CA 119.261 -0.976 . . . . 0.0 108.601 178.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.478 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.5 m-20 160.91 155.6 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.445 0 CA-C-N 114.485 -1.234 . . . . 0.0 108.687 -179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -91.44 12.84 2.17 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.006 1.804 . . . . 0.0 113.736 -178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -173.94 -57.23 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 112.516 0.562 . . . . 0.0 112.516 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.654 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 50.3 m95 -100.25 117.31 34.2 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.478 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 22.8 m0 -111.7 143.12 43.14 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.017 178.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.56 HG23 HD23 ' A' ' 64' ' ' LEU . 3.2 m -88.37 128.71 35.51 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.805 0.336 . . . . 0.0 111.059 179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.56 -168.12 19.54 Favored Glycine 0 C--N 1.33 0.213 0 C-N-CA 121.062 -0.59 . . . . 0.0 112.087 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.14 140.04 22.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 111.362 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.886 ' HB2' HG22 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -111.85 116.04 30.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.212 -179.93 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.407 ' HB3' ' O ' ' A' ' 58' ' ' LEU . 2.8 t60 65.47 -77.53 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.324 -179.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.9 t30 -146.88 12.28 1.11 Allowed 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.605 0.24 . . . . 0.0 111.614 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.494 ' O ' HD13 ' A' ' 35' ' ' LEU . 15.1 mttp -102.7 125.37 49.41 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mp -105.91 136.22 45.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.964 0.411 . . . . 0.0 111.35 -179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.6 -175.37 41.32 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.774 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.797 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -92.13 154.02 18.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.73 0.3 . . . . 0.0 110.832 -179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.496 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 4.5 p90 -140.94 162.65 47.31 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.182 -179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.535 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.0 Cg_endo -80.62 109.62 2.29 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 122.723 2.282 . . . . 0.0 112.295 179.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.61 -8.5 47.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.309 -179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.729 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -94.54 -31.39 13.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.829 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' B' ' 77' ' ' PRO . 0.2 OUTLIER -72.81 -41.51 64.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.722 179.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.73 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -123.02 154.76 28.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.125 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.704 ' HB3' HH21 ' A' ' 22' ' ' ARG . . . -119.94 150.35 50.65 Favored Pre-proline 0 N--CA 1.464 0.264 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.412 -179.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.615 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 46.3 Cg_exo -58.46 -178.98 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 122.752 2.301 . . . . 0.0 113.911 -179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 4.9 ttp -146.88 99.41 3.18 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.329 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.2 ttt -72.08 106.95 4.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.902 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 120.537 0.208 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.48 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 54.2 Cg_exo -53.37 129.41 33.49 Favored 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.513 2.142 . . . . 0.0 112.193 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 53.5 p -114.33 120.08 39.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.346 -179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.729 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.55 135.66 54.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.303 -179.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -105.92 127.53 53.2 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.652 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.509 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 6.4 mtm-85 -77.33 -5.57 50.02 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.319 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.04 1.51 12.88 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.364 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 8.5 t -129.7 26.44 5.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.982 0.42 . . . . 0.0 111.306 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.527 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -57.63 162.57 4.7 Favored Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.857 179.823 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 85.8 Cg_exo -46.05 122.64 5.49 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.512 2.141 . . . . 0.0 112.652 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.171 -0.919 . . . . 0.0 111.033 -179.976 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 112.408 -0.277 . . . . 0.0 112.408 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.447 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -104.11 39.11 1.7 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.057 0.456 . . . . 0.0 111.072 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.643 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -61.3 104.49 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.692 179.637 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 9.8 ptt180 -136.62 43.13 2.46 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.538 -179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.592 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 85.1 m95 -140.05 157.12 46.16 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.333 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -130.36 104.25 7.16 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.883 -0.327 . . . . 0.0 110.727 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.546 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 36.6 ttt180 -105.62 109.73 21.81 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.444 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -74.19 127.51 33.15 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 114.966 -1.016 . . . . 0.0 112.3 -178.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -99.94 -18.07 17.26 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.442 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 5.3 m-85 -136.22 178.24 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 114.033 -1.44 . . . . 0.0 108.863 179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.34 -173.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.154 0.502 . . . . 0.0 111.382 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.59 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 32.4 p90 -102.01 146.95 27.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.024 0.44 . . . . 0.0 111.971 -179.236 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.9 OUTLIER -100.22 12.59 36.7 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.771 -179.763 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.91 103.16 2.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.078 0.466 . . . . 0.0 110.982 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.479 HD12 ' HD3' ' B' ' 81' ' ' ARG . 7.7 mt -105.67 -10.42 16.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.422 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.498 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.83 174.02 6.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.991 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -89.87 -29.93 18.24 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.004 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.444 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -79.8 4.78 15.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.04 -179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.758 ' HG2' HD12 ' A' ' 64' ' ' LEU . 80.6 mt-10 -105.18 -170.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.226 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.51 HD21 ' CB ' ' A' ' 58' ' ' LEU . 5.1 tp -139.26 139.85 37.51 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.167 -179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.38 130.45 9.13 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.394 -0.907 . . . . 0.0 113.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.873 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.7 -173.92 2.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.843 0.354 . . . . 0.0 110.492 179.085 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 9.8 mtt180 -129.46 162.32 28.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.823 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.7 p -46.64 140.18 4.65 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.646 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 54.92 63.9 4.84 Favored Glycine 0 C--N 1.331 0.275 0 CA-C-N 115.688 -0.687 . . . . 0.0 113.245 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.546 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.8 mt-10 -135.21 164.86 26.74 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.847 0.356 . . . . 0.0 111.271 179.594 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 14.2 t -119.42 132.22 69.83 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.185 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.883 HG22 HD12 ' A' ' 58' ' ' LEU . 16.8 t -130.16 142.07 44.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -96.04 112.25 24.03 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.495 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 76.5 t -79.41 125.49 38.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.049 0.452 . . . . 0.0 111.018 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.492 HD12 ' HG2' ' A' ' 57' ' ' ARG . 2.0 mt -101.0 0.85 38.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.196 -179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.453 ' H ' HG12 ' A' ' 45' ' ' VAL . 6.3 t70 -165.99 73.22 0.17 Allowed 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.453 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.452 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -73.74 -3.01 25.81 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.792 179.31 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.6 m -75.34 113.92 13.28 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 119.303 -0.959 . . . . 0.0 108.483 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.502 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.4 m-20 162.18 161.8 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.586 -179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -92.56 2.54 3.78 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.086 1.858 . . . . 0.0 114.307 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.41 -54.23 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.68 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 25.6 m95 -100.67 116.67 33.14 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.736 0.303 . . . . 0.0 111.66 -178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.502 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 29.2 m0 -108.63 145.71 34.5 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.757 179.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.64 HG23 HD23 ' A' ' 64' ' ' LEU . 1.3 m -89.81 116.13 27.66 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.15 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.459 ' HA2' ' H ' ' A' ' 46' ' ' LEU . . . -140.93 -165.92 10.5 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 121.02 -0.609 . . . . 0.0 112.077 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.31 131.83 15.77 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 117.046 0.423 . . . . 0.0 111.666 179.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.883 HD12 HG22 ' A' ' 43' ' ' VAL . 0.7 OUTLIER -100.12 116.27 31.74 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.267 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER 66.66 -84.6 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.628 -179.494 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -140.7 9.83 2.21 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.825 0.345 . . . . 0.0 111.141 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -104.81 129.68 53.05 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.869 179.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -103.07 134.61 46.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.035 0.445 . . . . 0.0 111.597 -179.127 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 176.63 169.69 38.29 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.63 179.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.758 HD12 ' HG2' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -80.85 161.74 24.3 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.738 0.304 . . . . 0.0 110.996 -179.821 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -149.84 161.35 31.59 Favored Pre-proline 0 CA--C 1.532 0.267 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.109 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.559 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 68.7 Cg_endo -80.59 109.61 2.29 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.743 2.296 . . . . 0.0 112.362 179.339 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.81 -7.67 49.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.983 0.421 . . . . 0.0 110.585 179.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -93.15 -27.24 17.03 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.512 179.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -80.33 -39.66 28.2 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.975 179.839 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.682 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.2 m -122.14 156.29 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.474 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.426 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -116.1 147.42 39.28 Favored Pre-proline 0 N--CA 1.465 0.309 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.084 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.643 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 26.5 Cg_exo -64.67 137.19 53.14 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 122.443 2.095 . . . . 0.0 114.295 -178.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.4 tmm? -86.26 99.92 11.9 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.397 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.84 110.34 18.77 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.3 mtp180 . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.219 -0.896 . . . . 0.0 110.915 179.896 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.735 0.302 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -54.75 101.11 0.08 OUTLIER 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.651 2.234 . . . . 0.0 112.137 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 11.1 t -78.52 120.76 23.69 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.123 0.487 . . . . 0.0 111.068 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.577 HG23 ' HE1' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -104.33 137.84 31.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.237 -179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.537 ' O ' HG22 ' B' ' 83' ' ' THR . 1.8 m-20 -99.54 127.3 45.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.947 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.539 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 23.8 mtm-85 -76.75 -5.35 47.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.034 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.28 3.09 11.59 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.324 -179.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.537 HG22 ' O ' ' B' ' 80' ' ' ASP . 12.5 t -126.75 26.36 6.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.309 -179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.0 OUTLIER -62.69 160.51 35.17 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.744 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.68 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 93.3 Cg_exo -41.83 129.69 4.06 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 122.685 2.257 . . . . 0.0 112.769 -179.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.244 -179.698 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 112.439 -0.265 . . . . 0.0 112.439 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -123.84 97.31 5.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.011 0.434 . . . . 0.0 111.226 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.531 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -103.36 91.98 2.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.851 179.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.508 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 7.3 ptp180 -138.86 45.44 2.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.083 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.594 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 73.4 m95 -141.85 157.63 44.77 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.528 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.794 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.08 104.45 7.99 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.809 0.338 . . . . 0.0 110.58 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.631 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 8.3 ttt180 -103.35 109.04 20.51 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.418 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.97 119.05 21.57 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.179 -178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.5 mt -91.83 -15.63 27.92 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.457 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.6 m-85 -136.05 177.21 8.01 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.541 179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -54.25 -178.74 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.038 0.447 . . . . 0.0 111.364 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.646 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 16.9 p90 -102.51 146.84 27.53 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.668 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.846 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 0.0 OUTLIER -106.29 13.91 28.15 Favored 'General case' 0 CA--C 1.52 -0.178 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.637 179.639 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.646 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -68.67 102.57 1.53 Allowed 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 120.43 -0.508 . . . . 0.0 111.141 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.25 -9.43 19.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.927 179.317 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.9 mt-10 -101.09 152.88 20.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.941 179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.45 -29.83 64.03 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.129 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.447 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -77.41 1.47 18.98 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.132 -179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.855 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 71.3 mt-10 -108.62 -178.21 3.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.016 0.436 . . . . 0.0 111.37 -179.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.42 HD12 ' N ' ' A' ' 36' ' ' GLY . 0.1 OUTLIER -130.35 145.68 51.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.695 179.874 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.42 ' N ' HD12 ' A' ' 35' ' ' LEU . . . -117.75 131.24 9.21 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.238 -0.982 . . . . 0.0 113.198 179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.67 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -114.62 -173.31 2.28 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.954 0.407 . . . . 0.0 110.739 179.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 38' ' ' ARG . 7.5 mtm180 -129.42 163.95 24.71 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.765 179.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.2 t -51.58 143.43 12.37 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.89 0.376 . . . . 0.0 111.152 -179.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.81 54.52 35.98 Favored Glycine 0 CA--C 1.519 0.282 0 CA-C-N 115.873 -0.603 . . . . 0.0 113.014 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.571 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 16.7 mm-40 -126.14 165.9 18.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.851 0.358 . . . . 0.0 111.433 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.4 t -128.73 132.56 67.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.333 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.794 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 61.4 t -128.33 143.79 39.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.655 -179.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -93.3 109.41 20.95 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 178.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.508 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 96.1 t -79.77 139.15 18.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.032 0.444 . . . . 0.0 111.498 -178.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mt -105.38 -23.39 12.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.053 -179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -148.29 82.69 1.48 Allowed 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 111.712 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.462 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -78.48 -1.16 32.41 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.525 179.061 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -76.59 113.86 14.69 Favored 'General case' 0 N--CA 1.441 -0.88 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 178.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.51 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.5 m-20 163.79 163.97 0.06 OUTLIER Pre-proline 0 C--N 1.322 -0.6 0 CA-C-N 114.53 -1.213 . . . . 0.0 108.26 -178.81 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.482 ' HG2' ' OG1' ' B' ' 83' ' ' THR . 92.1 Cg_endo -93.66 -0.78 3.28 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 121.815 1.677 . . . . 0.0 114.536 -178.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -168.91 -40.51 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.646 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.2 m95 -110.16 114.12 27.36 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.92 -0.312 . . . . 0.0 111.596 -179.183 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.51 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 21.1 m0 -110.18 142.91 41.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.802 179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.647 HG23 HD23 ' A' ' 64' ' ' LEU . 2.9 m -86.27 116.52 24.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.081 179.393 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.76 168.41 26.88 Favored Glycine 0 CA--C 1.518 0.241 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.784 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.42 ' C ' HG13 ' A' ' 43' ' ' VAL . 11.2 ptt180 -127.22 131.71 50.58 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.231 0.515 . . . . 0.0 112.047 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.67 HD13 ' HB3' ' A' ' 37' ' ' PHE . 2.6 tt -99.89 117.46 34.25 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.15 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 65.14 -83.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.498 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -140.51 10.12 2.26 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.203 179.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 mtpp -107.05 125.87 51.59 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.138 179.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.08 147.9 26.87 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.873 0.368 . . . . 0.0 111.4 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.72 -170.11 40.39 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.459 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.855 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -100.28 148.88 24.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.616 0.246 . . . . 0.0 110.721 179.902 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.514 ' CE1' HG22 ' A' ' 70' ' ' VAL . 4.3 p90 -136.26 161.73 60.57 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.23 -179.479 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.846 ' HG3' ' HG3' ' A' ' 28' ' ' GLU . 90.5 Cg_endo -78.79 105.97 2.03 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.696 2.264 . . . . 0.0 112.493 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.49 -13.05 60.34 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.829 0.347 . . . . 0.0 110.865 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.733 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.53 -30.46 19.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.956 -179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.457 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -77.4 -41.32 40.48 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.054 -179.828 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.7 OUTLIER -123.14 163.04 22.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.183 179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -129.6 152.6 79.97 Favored Pre-proline 0 N--CA 1.463 0.216 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.816 -179.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 36.4 Cg_exo -61.87 -178.32 0.31 Allowed 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.998 2.465 . . . . 0.0 114.01 -179.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -146.62 99.86 3.26 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.432 -1.258 . . . . 0.0 109.94 -179.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 7.1 ttp -70.41 108.31 4.2 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.936 0.398 . . . . 0.0 111.288 -179.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp85 . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.838 179.796 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.6 0.238 . . . . 0.0 110.993 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -52.92 128.81 30.23 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 122.508 2.139 . . . . 0.0 112.163 179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -106.86 125.42 50.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.041 0.448 . . . . 0.0 111.518 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.733 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.54 135.91 54.06 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.017 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -108.2 133.66 52.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.188 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.518 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -78.19 -6.33 54.51 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.426 -179.853 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 86.9 p -75.67 1.39 14.69 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.493 -179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.482 ' OG1' ' HG2' ' A' ' 51' ' ' PRO . 9.0 t -129.43 26.5 5.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.861 0.362 . . . . 0.0 111.576 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.53 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.9 OUTLIER -62.42 161.06 28.54 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.568 179.603 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.646 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 90.6 Cg_exo -42.54 128.39 4.73 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.545 2.163 . . . . 0.0 112.711 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.065 -179.983 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.144 0 N-CA-C 112.478 -0.249 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -124.97 43.29 3.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.17 0.509 . . . . 0.0 110.84 179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -93.34 72.3 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.917 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.53 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.0 OUTLIER -123.6 58.85 1.13 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.426 179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.712 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.8 m95 -138.29 156.97 47.15 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.168 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.656 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.09 104.13 6.64 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-O 120.857 0.36 . . . . 0.0 110.598 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.565 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 10.0 ttt85 -106.9 108.99 20.77 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.528 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -76.55 118.36 19.13 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.209 -0.905 . . . . 0.0 112.135 -178.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -85.32 -13.76 48.6 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.496 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -139.67 178.32 7.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.206 -1.361 . . . . 0.0 108.913 179.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -54.3 -173.75 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.131 0.491 . . . . 0.0 111.477 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.665 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -99.97 147.79 25.2 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -102.96 11.89 36.79 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.354 179.514 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.59 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.54 103.42 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.045 0.45 . . . . 0.0 111.129 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.3 mt -103.1 -6.76 21.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.368 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -108.4 162.92 13.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.109 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.16 -32.78 50.41 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.941 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -73.96 -1.3 19.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.648 179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.603 ' HA ' ' N ' ' A' ' 64' ' ' LEU . 74.1 mt-10 -105.44 174.67 5.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.2 OUTLIER -120.68 139.37 53.12 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.568 179.953 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -110.58 114.82 3.87 Favored Glycine 0 N--CA 1.445 -0.7 0 C-N-CA 120.705 -0.759 . . . . 0.0 113.482 -179.516 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.793 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -109.58 -175.12 2.66 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.059 0.457 . . . . 0.0 110.544 179.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.461 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 33.1 mtt180 -129.19 -179.64 5.24 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.671 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -60.7 147.51 41.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.118 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.87 40.29 57.17 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.926 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.508 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 54.7 mm-40 -116.22 130.13 56.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.992 0.425 . . . . 0.0 111.425 -179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 t -91.76 134.14 31.05 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.794 179.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.656 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 96.4 t -130.55 141.87 45.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.67 -179.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.401 ' HA ' ' CE3' ' A' ' 20' ' ' TRP . 22.9 tt0 -94.46 109.43 21.3 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.53 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 72.3 t -79.58 134.99 26.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 121.029 0.442 . . . . 0.0 111.175 -179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.505 HD12 ' HG2' ' A' ' 57' ' ' ARG . 1.4 mt -103.05 -10.72 18.68 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.056 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.519 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 1.6 t70 -158.51 90.8 1.04 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.538 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -89.89 -1.16 57.92 Favored 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.787 179.423 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.7 t -74.72 113.87 12.49 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 119.181 -1.008 . . . . 0.0 108.382 178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.499 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 162.93 161.9 0.05 OUTLIER Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 114.801 -1.09 . . . . 0.0 108.901 -179.045 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -93.37 1.77 3.4 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 121.989 1.793 . . . . 0.0 114.453 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -167.62 -46.55 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.249 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.696 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.0 m95 -107.96 116.73 32.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.67 0.271 . . . . 0.0 111.677 -179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.519 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 29.1 m0 -110.49 140.02 45.15 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.861 179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.477 HG23 HD23 ' A' ' 64' ' ' LEU . 13.5 m -83.76 116.45 22.7 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.748 179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.33 -177.34 16.43 Favored Glycine 0 CA--C 1.517 0.202 0 C-N-CA 120.967 -0.635 . . . . 0.0 112.026 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HG2' HD12 ' A' ' 46' ' ' LEU . 20.5 ptt180 -142.87 133.05 24.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 117.209 0.504 . . . . 0.0 112.119 -179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.793 HD13 ' HB3' ' A' ' 37' ' ' PHE . 1.1 tt -99.48 116.9 32.7 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.795 179.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.402 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 14.3 m170 65.52 -85.87 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.441 -179.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.07 3.41 2.65 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.512 179.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.7 mtpp -98.44 128.1 44.67 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 179.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.21 142.0 34.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.022 0.439 . . . . 0.0 111.416 -179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.468 ' O ' HD23 ' A' ' 35' ' ' LEU . . . 167.19 155.05 8.84 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.775 -0.648 . . . . 0.0 112.603 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.605 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.2 OUTLIER -67.15 153.38 43.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.732 0.301 . . . . 0.0 110.945 179.999 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.487 ' CE1' HG22 ' A' ' 70' ' ' VAL . 3.0 p90 -139.59 161.39 57.0 Favored Pre-proline 0 CA--C 1.531 0.228 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.096 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.487 ' HB3' HG21 ' B' ' 79' ' ' ILE . 84.8 Cg_endo -79.46 106.2 1.98 Allowed 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.583 2.189 . . . . 0.0 112.294 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.415 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -66.79 -9.19 34.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.764 0.316 . . . . 0.0 111.203 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.666 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.76 -31.32 15.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.741 179.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.478 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -75.3 -40.51 58.49 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.908 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.581 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.13 160.08 26.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.582 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -122.85 151.24 60.55 Favored Pre-proline 0 N--CA 1.464 0.241 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.302 -179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.678 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 51.0 Cg_exo -55.93 178.97 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.759 2.306 . . . . 0.0 114.03 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.712 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.7 tmm? -153.78 100.31 2.36 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 114.925 -1.034 . . . . 0.0 110.625 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.9 ttm -70.67 105.71 3.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.802 0.334 . . . . 0.0 110.596 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 9.9 mtm180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.268 -0.872 . . . . 0.0 110.926 179.972 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.661 0.267 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.41 ' HB2' ' CD1' ' A' ' 69' ' ' TYR . 72.3 Cg_exo -50.2 127.53 20.11 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 122.814 2.343 . . . . 0.0 112.606 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 8.7 t -107.67 120.82 43.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.911 179.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.666 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.28 136.85 50.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -179.734 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -105.81 128.93 54.04 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.91 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.514 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 16.1 mtm-85 -72.83 -4.93 34.76 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.071 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -82.12 3.5 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.259 179.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 7.0 p -119.27 18.43 12.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.121 -179.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 0.4 OUTLIER -57.56 157.59 13.43 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.917 179.935 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.696 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 96.8 Cg_exo -43.35 111.44 0.23 Allowed 'Trans proline' 0 C--N 1.351 0.682 0 C-N-CA 122.797 2.331 . . . . 0.0 112.775 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.308 -0.853 . . . . 0.0 111.054 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.173 0 N-CA-C 112.572 -0.211 . . . . 0.0 112.572 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.19 46.52 1.73 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.926 0.393 . . . . 0.0 110.908 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.453 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 0.9 OUTLIER -69.75 104.25 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.287 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.54 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.4 ptt180 -146.25 43.05 1.21 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.682 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.598 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 68.3 m95 -139.6 157.37 45.92 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.96 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.68 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -128.1 104.23 7.66 Favored 'General case' 0 N--CA 1.446 -0.629 0 C-N-CA 120.727 -0.389 . . . . 0.0 110.714 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.583 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 22.2 ttp180 -103.15 109.4 20.97 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.434 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -77.82 118.67 20.38 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.213 -0.903 . . . . 0.0 112.203 -178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.4 -19.86 26.02 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 178.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.418 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 0.8 OUTLIER -132.37 178.33 6.9 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 114.332 -1.304 . . . . 0.0 109.114 178.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -52.36 -175.92 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.311 0.576 . . . . 0.0 111.825 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.62 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 32.7 p90 -101.07 147.09 26.62 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.825 -0.625 . . . . 0.0 112.209 -178.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.521 ' HG3' ' HG3' ' A' ' 66' ' ' PRO . 1.1 mm-40 -101.22 11.18 39.85 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.468 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.566 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.77 103.92 2.3 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.048 0.452 . . . . 0.0 111.54 -179.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 11.7 mt -109.9 -3.2 16.74 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.078 179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.511 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.6 mm-40 -109.54 162.08 14.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.906 0.384 . . . . 0.0 111.439 -179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -69.81 -41.38 75.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.897 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.52 3.04 8.29 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.695 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.883 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 88.5 mt-10 -105.2 154.73 19.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.949 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 0.1 OUTLIER -112.28 140.28 47.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.348 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.77 129.93 9.23 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.418 -0.896 . . . . 0.0 113.707 -179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.803 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.2 OUTLIER -113.76 -174.77 2.53 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.949 0.404 . . . . 0.0 110.511 179.094 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.69 171.29 13.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.04 179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -54.97 146.51 17.62 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.284 -179.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.74 52.84 36.04 Favored Glycine 0 N--CA 1.452 -0.281 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.999 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.3 mm-40 -129.31 144.39 51.21 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.004 0.431 . . . . 0.0 111.427 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 41.7 t -100.47 133.48 43.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.1 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.687 HG22 HD12 ' A' ' 58' ' ' LEU . 51.4 t -130.85 142.04 44.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.513 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -96.14 111.47 23.5 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.54 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 91.6 t -79.75 133.85 28.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 120.882 0.372 . . . . 0.0 111.061 -179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -93.43 -24.55 18.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.124 -179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.84 95.68 1.2 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.628 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.403 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.3 OUTLIER -81.24 5.4 17.18 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.585 179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 31.2 t -76.55 113.6 14.35 Favored 'General case' 0 N--CA 1.443 -0.804 0 C-N-CA 119.272 -0.971 . . . . 0.0 108.457 178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.497 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.54 158.28 0.04 OUTLIER Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 114.603 -1.181 . . . . 0.0 108.716 -179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -91.2 7.42 3.49 Favored 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.017 1.811 . . . . 0.0 114.064 -178.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.99 -57.64 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 112.319 0.489 . . . . 0.0 112.319 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.653 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 62.5 m95 -96.83 113.83 25.41 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 111.64 0.237 . . . . 0.0 111.64 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.497 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 32.4 m0 -107.42 142.68 36.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.716 0.293 . . . . 0.0 110.612 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.424 HG23 HD23 ' A' ' 64' ' ' LEU . 1.4 m -84.11 116.56 22.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.626 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -146.51 -176.69 20.53 Favored Glycine 0 C--N 1.332 0.324 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.151 -179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.597 ' HB3' HD23 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -145.42 137.11 25.33 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.121 0.486 . . . . 0.0 112.006 -179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.803 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.4 OUTLIER -104.56 113.79 27.6 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.072 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 16.2 m170 66.55 -79.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.657 -179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 3.7 t30 -142.6 8.88 1.77 Allowed 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.4 mtmm -100.58 125.16 46.92 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' A' ' 57' ' ' ARG . 0.8 OUTLIER -103.91 144.6 31.3 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.993 0.425 . . . . 0.0 111.352 -179.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 164.58 -158.24 30.89 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.457 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.883 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.1 OUTLIER -111.31 154.37 24.61 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.688 0.28 . . . . 0.0 110.843 -179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.479 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.7 p90 -141.17 162.57 47.16 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.394 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.813 ' HB3' HG13 ' B' ' 79' ' ' ILE . 58.2 Cg_endo -80.1 114.82 3.16 Favored 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.977 2.451 . . . . 0.0 112.785 179.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -73.2 -11.88 60.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.612 0.244 . . . . 0.0 111.237 179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.922 HD21 HG12 ' B' ' 79' ' ' ILE . 0.9 OUTLIER -92.58 -23.4 19.05 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.196 -179.724 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -82.96 -40.92 19.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.062 -179.833 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.68 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.8 OUTLIER -122.74 161.44 24.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 C-N-CA 120.87 -0.332 . . . . 0.0 111.495 -179.702 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 72' ' ' PRO . . . -126.45 148.98 66.32 Favored Pre-proline 0 N--CA 1.464 0.251 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.503 -179.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.598 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 32.1 Cg_exo -60.31 -178.56 0.2 Allowed 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 122.785 2.323 . . . . 0.0 113.715 -179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 5.9 tmm? -147.41 99.48 3.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.313 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.3 ttt -72.31 108.41 5.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.898 0.38 . . . . 0.0 110.966 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.297 -0.858 . . . . 0.0 110.951 179.944 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.663 0.268 . . . . 0.0 110.981 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 6.5 Cg_endo -50.93 124.67 14.26 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.918 2.412 . . . . 0.0 112.512 -179.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.1 t -86.49 144.99 26.99 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.922 HG12 HD21 ' A' ' 68' ' ' ASN . 0.4 OUTLIER -112.03 137.58 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.564 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.81 -179.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.402 ' HB3' HG23 ' B' ' 83' ' ' THR . 0.9 OUTLIER -109.95 103.82 12.64 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.096 -0.956 . . . . 0.0 110.376 179.447 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.486 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 0.6 OUTLIER -68.51 -5.78 21.48 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.308 -179.469 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.54 3.57 28.0 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.715 179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.402 HG23 ' HB3' ' B' ' 80' ' ' ASP . 0.8 OUTLIER -121.47 17.67 11.32 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.591 -179.582 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.5 OUTLIER -54.74 158.98 3.88 Favored Pre-proline 0 C--N 1.331 -0.228 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.949 179.855 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.653 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 77.2 Cg_exo -48.28 101.16 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.56 2.173 . . . . 0.0 112.515 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.318 -0.848 . . . . 0.0 111.139 179.969 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.8 94.45 5.12 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.131 0.491 . . . . 0.0 111.041 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.429 HG22 ' H ' ' A' ' 18' ' ' VAL . 2.1 m -65.2 122.63 16.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.022 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.491 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 8.4 ptt180 -141.34 51.9 1.57 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.943 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.847 ' HB2' ' H ' ' A' ' 73' ' ' MET . 85.6 m95 -141.97 156.81 45.46 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.63 -179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.654 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -132.42 104.32 6.65 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-O 120.708 0.289 . . . . 0.0 110.376 -179.904 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.57 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 0.5 OUTLIER -108.41 109.27 20.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.758 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.17 129.57 36.16 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.14 -0.936 . . . . 0.0 112.55 -178.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.8 mt -97.51 -17.44 19.6 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -137.98 179.11 6.63 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 114.164 -1.38 . . . . 0.0 109.04 179.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -50.31 -175.98 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.311 0.577 . . . . 0.0 111.75 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.541 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 41.5 p90 -101.54 147.01 26.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.25 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.467 ' HB2' ' HG3' ' A' ' 66' ' ' PRO . 1.0 OUTLIER -98.2 11.34 38.14 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.345 179.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -70.07 104.54 2.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.97 0.414 . . . . 0.0 111.536 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -112.06 -7.44 14.09 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.797 179.594 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.461 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -101.21 164.07 11.97 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.487 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.36 -33.23 58.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.793 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.523 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -85.14 16.14 3.73 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.334 -179.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.637 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 92.8 mt-10 -113.54 -179.47 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.352 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.83 HD11 ' HB3' ' A' ' 58' ' ' LEU . 0.2 OUTLIER -132.74 139.12 47.45 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.694 -0.684 . . . . 0.0 110.239 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.22 129.03 8.66 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.417 -179.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.567 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.2 OUTLIER -111.91 -173.12 2.18 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.83 0.348 . . . . 0.0 110.557 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 38' ' ' ARG . 3.4 mtm180 -129.92 170.32 14.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.163 179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -53.71 140.05 30.66 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.866 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.09 57.5 18.79 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.837 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.57 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 17.9 mm-40 -136.48 132.37 35.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.821 0.343 . . . . 0.0 111.253 179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.1 t -96.08 136.09 28.09 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.964 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.583 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 55.0 t -129.54 142.78 43.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.832 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -90.54 110.1 21.24 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.835 0.35 . . . . 0.0 110.069 179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.494 HG12 ' H ' ' A' ' 47' ' ' ASP . 58.2 t -80.03 137.52 21.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.087 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mt -115.97 2.94 13.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.247 -179.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.534 ' HB2' ' HB ' ' A' ' 55' ' ' THR . 0.2 OUTLIER -158.68 64.87 0.42 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.387 -179.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -71.81 -8.64 55.51 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.796 179.35 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 t -72.11 113.25 8.94 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 119.194 -1.002 . . . . 0.0 108.297 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.495 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.7 m-20 162.8 163.35 0.05 OUTLIER Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 114.902 -1.045 . . . . 0.0 109.039 -179.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 79.0 Cg_endo -92.43 -2.9 3.83 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.067 1.845 . . . . 0.0 114.221 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -168.57 -38.72 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.811 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 41.8 m95 -107.2 112.9 26.0 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.439 -179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.495 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.2 m0 -111.18 139.29 46.68 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.926 -0.31 . . . . 0.0 110.511 178.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.613 HG23 HD23 ' A' ' 64' ' ' LEU . 6.5 m -86.85 116.26 24.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.198 179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -138.26 -175.78 14.14 Favored Glycine 0 C--O 1.228 -0.233 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.518 ' O ' HG13 ' A' ' 43' ' ' VAL . 18.2 ptt180 -141.17 133.59 28.32 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 117.446 0.623 . . . . 0.0 112.215 -179.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.83 ' HB3' HD11 ' A' ' 35' ' ' LEU . 6.1 tt -99.77 118.33 36.02 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.154 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.463 ' HB2' HD23 ' A' ' 58' ' ' LEU . 1.6 m-70 65.15 -85.73 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.689 -179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -140.33 10.98 2.33 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.913 0.387 . . . . 0.0 111.151 179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -107.28 132.07 53.5 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.207 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -102.62 141.27 35.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.941 0.4 . . . . 0.0 111.074 -179.251 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 172.98 158.39 17.21 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.595 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.709 HD22 ' HG2' ' B' ' 85' ' ' PRO . 0.3 OUTLIER -72.44 162.03 30.02 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.768 0.318 . . . . 0.0 110.941 -179.917 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.468 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 2.8 p90 -150.32 160.95 32.15 Favored Pre-proline 0 C--N 1.331 -0.22 0 CA-C-N 116.499 -0.318 . . . . 0.0 110.972 -179.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.632 ' HB3' HG13 ' B' ' 79' ' ' ILE . 98.5 Cg_endo -80.22 110.99 2.58 Favored 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.534 2.156 . . . . 0.0 112.245 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.6 -20.16 65.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.781 -179.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.788 HD21 HG12 ' B' ' 79' ' ' ILE . 0.5 OUTLIER -86.48 -28.9 23.17 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.551 -179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.665 ' HA ' ' HG2' ' B' ' 77' ' ' PRO . 0.7 OUTLIER -74.43 -40.82 61.72 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.656 0.265 . . . . 0.0 110.936 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.654 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.0 OUTLIER -122.9 149.25 26.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-O 120.932 0.396 . . . . 0.0 111.517 -179.707 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -108.03 147.62 35.86 Favored Pre-proline 0 N--CA 1.462 0.171 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.947 -179.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 39.5 Cg_exo -58.88 -179.63 0.16 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.551 2.167 . . . . 0.0 113.989 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.847 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 6.8 ttp -145.86 106.74 4.13 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.134 -179.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 28.8 ttm -70.4 105.77 3.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.874 0.369 . . . . 0.0 110.889 -179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.908 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.475 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.541 0.21 . . . . 0.0 111.123 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.665 ' HG2' ' HA ' ' A' ' 69' ' ' TYR . 8.5 Cg_endo -53.23 92.19 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.748 2.299 . . . . 0.0 112.645 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.61 135.12 52.4 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-O 121.421 0.629 . . . . 0.0 110.306 179.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.788 HG12 HD21 ' A' ' 68' ' ' ASN . 0.5 OUTLIER -99.15 141.53 16.46 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.878 0 CA-C-N 114.954 -1.021 . . . . 0.0 112.276 -178.433 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.514 ' H ' HD13 ' B' ' 79' ' ' ILE . 7.0 m-20 -98.37 106.21 18.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.314 179.523 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.421 ' HD3' HD12 ' A' ' 30' ' ' LEU . 6.6 mtm-85 -65.03 -5.75 7.09 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.569 -179.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -86.44 2.94 45.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.821 0.343 . . . . 0.0 110.859 179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . . . . . . . . . 2.2 p -119.74 20.05 12.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.515 -179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.486 ' HA ' ' CB ' ' A' ' 53' ' ' TRP . 0.1 OUTLIER -61.6 159.1 35.67 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.701 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.811 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 80.7 Cg_exo -45.28 101.49 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.649 0 C-N-CA 122.609 2.206 . . . . 0.0 112.607 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.106 0 CA-C-O 118.212 -0.899 . . . . 0.0 111.15 -179.885 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 N-CA-C 112.686 -0.165 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.3 95.34 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.261 0.553 . . . . 0.0 111.524 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 1.3 m -86.39 122.18 38.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.785 179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.573 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.5 ptm180 -152.47 51.84 0.77 Allowed 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.196 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.573 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 88.4 m95 -139.31 156.65 46.9 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 120.735 0.302 . . . . 0.0 111.013 -179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.509 ' HB1' HG21 ' A' ' 70' ' ' VAL . . . -133.91 104.08 6.12 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 120.821 0.344 . . . . 0.0 110.188 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.589 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 20.1 ttt180 -106.9 109.4 21.29 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 178.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.545 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -75.77 118.17 18.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.333 -0.849 . . . . 0.0 111.911 -178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.68 -19.32 29.41 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 178.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.47 ' HB2' ' CE2' ' A' ' 69' ' ' TYR . 4.3 m-85 -134.07 178.01 7.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.022 179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -53.07 -178.06 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.159 0.504 . . . . 0.0 111.193 179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.555 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 30.4 p90 -101.05 146.51 27.34 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.622 -179.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.42 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -100.24 11.58 39.04 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.759 -179.828 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.705 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -70.38 102.79 2.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.013 0.435 . . . . 0.0 111.269 -179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.2 OUTLIER -108.05 -10.24 15.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.246 179.612 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.49 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.1 mm-40 -95.51 178.31 5.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.121 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 -42.33 13.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.052 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.507 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.2 OUTLIER -78.77 20.53 0.45 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.734 179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.705 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -109.33 174.0 6.07 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.54 -179.461 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.546 HD11 ' HB3' ' A' ' 58' ' ' LEU . 21.6 tp -126.44 138.46 53.53 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.069 179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -118.72 125.96 6.63 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.496 -0.859 . . . . 0.0 113.545 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.5 -172.87 2.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.847 0.356 . . . . 0.0 110.559 179.026 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.3 mtm180 -129.32 168.7 15.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.089 179.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 146.33 17.37 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.143 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.401 ' N ' ' O ' ' A' ' 23' ' ' ALA . . . 51.37 49.81 43.52 Favored Glycine 0 C--N 1.333 0.361 0 CA-C-N 115.912 -0.586 . . . . 0.0 112.911 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 64.3 mm-40 -126.81 134.87 50.47 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.794 0.331 . . . . 0.0 111.395 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 40.2 t -93.11 132.51 37.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.875 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.61 HG13 ' O ' ' A' ' 57' ' ' ARG . 55.1 t -130.7 140.58 48.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.308 -179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -91.55 114.37 26.89 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.807 0.337 . . . . 0.0 110.243 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.573 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 71.5 t -81.44 139.14 18.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.448 -179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.32 -17.09 16.04 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.059 179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.538 ' O ' ' HB3' ' A' ' 54' ' ' TRP . 0.2 OUTLIER -159.75 104.81 1.58 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.242 -179.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.1 m -96.55 2.32 52.24 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.008 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 43.2 m -77.72 113.59 15.72 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 119.159 -1.017 . . . . 0.0 108.625 178.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.498 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 5.9 m-20 162.69 158.69 0.05 OUTLIER Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 114.764 -1.107 . . . . 0.0 108.729 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -92.02 7.9 3.09 Favored 'Trans proline' 0 N--CA 1.453 -0.91 0 C-N-CA 122.015 1.81 . . . . 0.0 113.91 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.27 -56.17 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 112.449 0.537 . . . . 0.0 112.449 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.69 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 59.4 m95 -98.6 114.03 26.32 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 111.672 0.249 . . . . 0.0 111.672 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.538 ' HB3' ' O ' ' A' ' 47' ' ' ASP . 41.3 m0 -106.86 148.99 27.89 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.759 0.314 . . . . 0.0 110.466 178.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 58.5 m -88.13 119.05 28.14 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.06 179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -148.53 174.48 28.18 Favored Glycine 0 CA--C 1.518 0.269 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.095 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.61 ' O ' HG13 ' A' ' 43' ' ' VAL . 7.4 ptt180 -135.1 134.9 40.75 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.239 0.543 . . . . 0.0 111.895 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.614 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.0 OUTLIER -99.02 116.92 32.36 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.761 -179.684 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER 63.83 -78.73 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.764 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -145.82 15.57 1.39 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.89 0.376 . . . . 0.0 110.993 179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 9.0 mtpt -113.74 128.2 56.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.897 179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.6 144.81 30.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.018 0.437 . . . . 0.0 111.493 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.89 158.38 10.81 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.824 -0.626 . . . . 0.0 112.845 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.905 HD22 ' HG2' ' B' ' 85' ' ' PRO . 3.9 mt -66.78 144.7 56.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.728 0.299 . . . . 0.0 111.201 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.518 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.0 p90 -132.74 159.84 70.89 Favored Pre-proline 0 C--N 1.332 -0.157 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.936 179.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.572 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 63.2 Cg_endo -79.2 109.18 2.49 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.793 2.328 . . . . 0.0 112.673 179.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.85 -8.1 52.31 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.874 0.368 . . . . 0.0 110.774 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.62 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -92.92 -27.44 17.07 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.583 179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.47 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -82.26 -39.8 22.47 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.092 -179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.589 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 0.6 OUTLIER -122.76 157.04 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-O 120.869 0.366 . . . . 0.0 111.814 -179.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -118.77 150.37 48.26 Favored Pre-proline 0 N--CA 1.464 0.234 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.14 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.573 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 34.1 Cg_exo -63.46 136.08 52.95 Favored 'Trans proline' 0 C--N 1.35 0.609 0 C-N-CA 122.71 2.274 . . . . 0.0 114.263 -178.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 2.2 ttp -79.94 101.13 8.43 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.471 178.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.6 ttm -83.75 110.91 18.7 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.893 0.377 . . . . 0.0 111.015 -179.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.6 mtp180 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.248 -0.882 . . . . 0.0 111.009 -179.964 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.69 0.281 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -54.3 127.04 24.22 Favored 'Trans proline' 0 C--N 1.346 0.405 0 C-N-CA 122.66 2.24 . . . . 0.0 112.336 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.42 128.03 46.59 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.057 0.456 . . . . 0.0 111.058 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.62 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.3 OUTLIER -115.56 136.22 53.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.47 -179.746 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.431 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -105.59 116.82 32.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.396 179.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.647 ' HB3' ' HD2' ' B' ' 84' ' ' LYS . 23.4 mtm-85 -74.4 -5.28 41.5 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.353 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.6 p -72.79 0.97 9.46 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.435 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.431 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.2 t -129.34 26.24 5.41 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.811 0.338 . . . . 0.0 111.676 -179.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.647 ' HD2' ' HB3' ' B' ' 81' ' ' ARG . 0.1 OUTLIER -55.36 159.19 4.69 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.786 179.63 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.905 ' HG2' HD22 ' A' ' 64' ' ' LEU . 86.8 Cg_exo -47.93 104.29 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.467 2.112 . . . . 0.0 112.624 -179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.025 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.561 -0.215 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.415 ' HD3' HH11 ' A' ' 17' ' ' ARG . 0.0 OUTLIER -125.62 100.82 6.61 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.125 0.488 . . . . 0.0 111.148 179.99 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.699 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.8 m -94.92 80.85 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.23 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.48 ' O ' ' HB ' ' A' ' 45' ' ' VAL . 2.3 ptp180 -127.77 45.22 2.78 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.194 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.643 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 70.6 m95 -139.64 157.47 45.72 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.513 -179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.83 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -120.58 103.61 9.29 Favored 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 179.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.575 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.0 OUTLIER -106.29 109.1 20.93 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -77.27 130.88 37.78 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.815 -1.084 . . . . 0.0 112.242 -178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.446 HD21 ' HD3' ' A' ' 22' ' ' ARG . 2.0 mt -104.68 -15.86 15.14 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HB2' ' A' ' 24' ' ' LEU . 1.7 m-85 -138.03 178.8 6.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.055 -1.43 . . . . 0.0 108.857 179.287 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -52.79 -172.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.088 0.471 . . . . 0.0 111.122 179.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.492 ' HB3' ' H ' ' A' ' 37' ' ' PHE . 33.5 p90 -101.45 146.06 28.13 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.195 0.522 . . . . 0.0 111.973 -179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.943 ' HB3' ' HG3' ' A' ' 66' ' ' PRO . 0.7 OUTLIER -96.77 4.55 51.71 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.58 -179.336 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.425 ' HB3' ' HD2' ' A' ' 27' ' ' PHE . . . -69.04 102.62 1.66 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.01 0.433 . . . . 0.0 111.097 -179.271 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.403 HD12 ' NH1' ' B' ' 81' ' ' ARG . 18.5 mt -100.0 -9.79 22.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.201 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.46 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -104.43 166.85 10.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.139 -179.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -85.35 -30.46 23.66 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.997 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.4 OUTLIER -75.94 3.53 10.02 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.634 179.688 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.693 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 82.2 mt-10 -107.0 -171.68 1.93 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.143 -179.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.483 HD22 ' HA ' ' A' ' 57' ' ' ARG . 13.3 tp -135.14 139.62 44.77 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -115.95 133.62 10.95 Favored Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.592 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.564 ' HZ ' ' HD2' ' A' ' 66' ' ' PRO . 0.1 OUTLIER -115.57 -175.02 2.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.876 0.37 . . . . 0.0 110.553 179.366 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 3.7 mtt180 -129.37 164.57 23.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.773 179.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 24.6 t -49.3 136.62 15.41 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.404 -179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 58.55 64.28 4.46 Favored Glycine 0 N--CA 1.452 -0.25 0 CA-C-N 115.857 -0.61 . . . . 0.0 112.931 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 5.0 mt-10 -140.99 138.01 33.42 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.954 0.407 . . . . 0.0 111.74 -179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.5 t -96.1 132.89 39.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.092 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.83 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 48.5 t -130.55 144.31 38.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.144 -179.713 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 50.1 tt0 -94.21 118.52 31.68 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 179.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.48 ' HB ' ' O ' ' A' ' 19' ' ' ARG . 56.1 t -79.84 133.8 28.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.935 0.398 . . . . 0.0 110.852 -179.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.515 HD13 ' HG2' ' A' ' 57' ' ' ARG . 6.7 mp -94.31 -22.76 18.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.844 -0.617 . . . . 0.0 111.462 -179.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -163.27 92.67 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.855 0.359 . . . . 0.0 111.309 179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.414 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -76.65 1.97 15.45 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.702 179.31 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.1 m -75.2 113.78 12.95 Favored 'General case' 0 N--CA 1.443 -0.814 0 C-N-CA 119.277 -0.969 . . . . 0.0 108.468 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.517 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.8 m-20 158.98 158.75 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.503 -179.043 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 97.6 Cg_endo -91.07 7.3 3.56 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.01 1.807 . . . . 0.0 114.144 -178.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.9 -58.23 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.724 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 43.4 m95 -96.89 114.21 25.82 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.708 0.289 . . . . 0.0 111.626 -178.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.517 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.7 m0 -106.55 148.75 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.535 178.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.745 HG23 HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -91.29 120.75 32.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.357 179.83 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.409 ' HA2' ' HB2' ' A' ' 46' ' ' LEU . . . -150.82 -167.24 14.41 Favored Glycine 0 CA--C 1.52 0.402 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.937 179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.607 ' HD3' HD23 ' A' ' 62' ' ' LEU . 7.7 ptt180 -150.91 137.72 18.97 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 121.076 0.465 . . . . 0.0 111.981 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.584 HD12 HG22 ' A' ' 43' ' ' VAL . 4.0 tt -99.59 114.47 27.52 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.707 179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HB2' ' O ' ' A' ' 58' ' ' LEU . 39.1 m-70 65.0 -85.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.521 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -133.25 -2.74 3.12 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 6.8 mtpt -95.88 129.81 43.01 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 110.177 -0.305 . . . . 0.0 110.177 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.607 HD23 ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -102.91 157.74 16.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.862 0.363 . . . . 0.0 111.123 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 155.87 164.45 13.26 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.819 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.745 HD23 HG23 ' A' ' 55' ' ' THR . 0.2 OUTLIER -78.8 142.92 36.54 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.65 0.262 . . . . 0.0 110.503 179.691 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.476 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 1.9 p90 -133.1 160.43 68.69 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.662 0.267 . . . . 0.0 111.188 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.943 ' HG3' ' HB3' ' A' ' 28' ' ' GLU . 45.1 Cg_endo -83.98 116.04 2.1 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.818 2.345 . . . . 0.0 112.885 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -72.07 -10.94 60.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.768 0.318 . . . . 0.0 110.82 179.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.684 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -86.38 -31.92 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.649 179.781 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.459 ' HA ' ' CB ' ' B' ' 77' ' ' PRO . 0.3 OUTLIER -75.03 -44.94 45.05 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.813 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.615 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.9 OUTLIER -123.5 154.18 29.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.228 -179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -120.42 151.23 53.43 Favored Pre-proline 0 N--CA 1.463 0.19 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.336 -179.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.699 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 52.1 Cg_exo -57.19 -179.13 0.1 OUTLIER 'Trans proline' 0 C--N 1.351 0.658 0 C-N-CA 122.896 2.397 . . . . 0.0 114.08 -179.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 1.5 ttp -154.8 120.81 5.21 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.609 -179.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.61 109.97 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.926 0.394 . . . . 0.0 110.894 -179.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.894 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.726 0.298 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.459 ' CB ' ' HA ' ' A' ' 69' ' ' TYR . 51.6 Cg_exo -54.45 131.16 43.85 Favored 'Trans proline' 0 C--N 1.346 0.431 0 C-N-CA 122.623 2.215 . . . . 0.0 112.415 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.79 116.96 33.6 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.265 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.684 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.91 141.57 32.77 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 115.485 -0.779 . . . . 0.0 111.37 -179.771 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.45 ' O ' HG22 ' B' ' 83' ' ' THR . 1.2 m-20 -104.11 124.9 49.91 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.559 179.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.55 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 15.5 mtm-85 -77.22 -5.61 49.91 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.32 -179.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.51 3.29 11.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.488 -179.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.45 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.3 t -129.08 26.21 5.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.762 0.315 . . . . 0.0 111.73 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.55 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 18.3 mtpt -59.11 159.2 15.16 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.479 179.471 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.724 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 72.0 Cg_exo -49.54 101.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.281 1.987 . . . . 0.0 112.301 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.187 -0.911 . . . . 0.0 111.146 -179.906 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.165 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.12 92.61 2.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.042 0.448 . . . . 0.0 111.139 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 97.1 t -93.43 100.49 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.224 -179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.471 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 10.4 ptp180 -160.72 60.97 0.31 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.174 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.616 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 76.8 m95 -140.19 156.72 46.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.569 -179.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.635 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -127.27 103.76 7.57 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 120.815 0.34 . . . . 0.0 110.222 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.548 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 11.6 ttt180 -107.72 109.08 20.58 Favored 'General case' 0 N--CA 1.448 -0.529 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -78.32 118.42 20.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.057 -0.974 . . . . 0.0 112.422 -178.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 21.5 mt -83.63 -14.06 52.81 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.169 -1.048 . . . . 0.0 108.169 177.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.508 ' O ' ' HB1' ' A' ' 23' ' ' ALA . 2.1 m-85 -135.29 178.33 7.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.973 179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.38 -173.25 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.013 0.435 . . . . 0.0 111.264 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.654 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 33.0 p90 -100.55 147.47 25.89 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 -179.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -101.48 11.17 39.55 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.345 179.656 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.559 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.82 103.27 2.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.982 0.42 . . . . 0.0 111.175 -179.387 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 7.9 mt -105.08 -10.89 16.87 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.605 179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.45 ' HG3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -103.86 152.32 22.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.075 179.976 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.36 -21.19 62.06 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.796 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.459 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 1.0 OUTLIER -84.45 8.23 17.1 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.827 179.863 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.776 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 65.2 mt-10 -116.13 -176.47 2.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.108 -179.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.904 HD21 ' HB2' ' A' ' 58' ' ' LEU . 1.8 tp -128.84 139.17 52.29 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.249 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.73 123.98 6.47 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.534 -0.841 . . . . 0.0 113.908 -179.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.654 ' O ' ' HB3' ' A' ' 27' ' ' PHE . 0.2 OUTLIER -113.92 -174.65 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 178.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 22.8 mtp85 -130.36 -179.57 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.878 0.371 . . . . 0.0 111.463 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.68 145.83 47.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.131 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 52.84 40.13 56.75 Favored Glycine 0 C--N 1.331 0.272 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.901 179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.548 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 66.1 mm-40 -111.65 153.93 25.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.821 0.344 . . . . 0.0 111.008 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -116.15 132.0 66.98 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.086 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.635 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 47.4 t -130.22 144.2 38.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.051 -179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -94.85 114.44 26.31 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.617 179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.5 HG12 ' H ' ' A' ' 47' ' ' ASP . 97.4 t -79.99 137.15 22.1 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.796 0.332 . . . . 0.0 110.247 179.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.8 mt -109.38 -0.81 18.83 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 112.281 0.475 . . . . 0.0 112.281 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.5 ' H ' HG12 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -143.99 -60.63 0.39 Allowed 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.557 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.2 OUTLIER 58.95 -1.96 0.1 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.724 -178.917 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.475 ' H ' ' C ' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -81.84 114.13 20.26 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 178.012 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.519 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.0 m-20 161.04 161.27 0.04 OUTLIER Pre-proline 0 C--N 1.328 -0.359 0 O-C-N 124.329 1.018 . . . . 0.0 108.838 -178.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -92.38 6.95 3.17 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.176 1.917 . . . . 0.0 113.606 -179.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -170.95 -57.58 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 112.323 0.49 . . . . 0.0 112.323 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.71 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 39.8 m95 -96.79 113.4 24.95 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.757 0.313 . . . . 0.0 111.205 -179.179 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.557 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 44.2 m0 -104.81 145.53 30.24 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.15 179.486 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 16.3 m -87.46 116.07 25.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.315 178.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -140.22 -172.09 12.69 Favored Glycine 0 C--O 1.228 -0.246 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.063 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -151.0 136.47 17.81 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 117.099 0.45 . . . . 0.0 111.999 -179.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.904 ' HB2' HD21 ' A' ' 35' ' ' LEU . 4.3 tt -99.4 113.48 25.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.662 179.004 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 2.5 m170 64.54 -85.11 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.444 -179.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 24.7 p30 -134.12 0.1 3.1 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.656 179.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.0 mtpp -95.79 127.58 41.94 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 179.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mp -103.18 139.02 39.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 111.604 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 175.9 160.07 22.78 Favored Glycine 0 N--CA 1.45 -0.427 0 CA-C-N 115.703 -0.681 . . . . 0.0 112.672 179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.776 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.2 OUTLIER -75.01 154.18 38.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.639 0.257 . . . . 0.0 110.925 -179.88 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' CE1' HG22 ' A' ' 70' ' ' VAL . 2.6 p90 -142.54 160.91 52.34 Favored Pre-proline 0 CA--C 1.532 0.256 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.27 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.551 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 70.9 Cg_endo -80.62 111.82 2.61 Favored 'Trans proline' 0 C--N 1.35 0.635 0 C-N-CA 122.803 2.336 . . . . 0.0 112.48 179.403 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -71.77 -12.77 61.46 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.78 0.324 . . . . 0.0 110.932 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.677 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -88.57 -29.21 20.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.601 179.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.503 ' CE2' ' HB2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -77.67 -41.09 39.35 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.535 179.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.618 HG21 ' HB1' ' A' ' 21' ' ' ALA . 0.6 OUTLIER -123.27 161.29 25.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.352 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -130.53 151.83 79.32 Favored Pre-proline 0 N--CA 1.463 0.198 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.097 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.616 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.8 Cg_exo -57.39 -178.95 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 122.716 2.277 . . . . 0.0 113.828 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 3.5 ttp -148.43 99.26 3.0 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.313 -179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 6.8 tmm? -72.36 106.27 4.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.96 0.41 . . . . 0.0 110.955 -179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 . . . . . 0 C--O 1.25 1.104 0 CA-C-O 118.253 -0.879 . . . . 0.0 110.98 179.953 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . 0.469 ' HA ' ' HD2' ' B' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.696 0.284 . . . . 0.0 111.01 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.469 ' HD2' ' HA ' ' B' ' 76' ' ' ALA . 5.6 Cg_endo -49.82 128.98 22.98 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.858 2.372 . . . . 0.0 112.145 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.9 t -114.9 127.04 55.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.051 0.453 . . . . 0.0 111.152 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.677 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.44 134.94 57.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.159 -179.685 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.524 ' O ' HG22 ' B' ' 83' ' ' THR . 3.0 m-20 -96.94 129.04 44.46 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.93 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.573 ' NH1' ' HE3' ' B' ' 84' ' ' LYS . 4.2 mtm105 -77.52 -5.57 50.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.367 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 34.2 t -76.92 3.73 11.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.269 -179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.524 HG22 ' O ' ' B' ' 80' ' ' ASP . 9.0 t -128.3 26.41 5.71 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.573 ' HE3' ' NH1' ' B' ' 81' ' ' ARG . 0.2 OUTLIER -60.31 159.36 23.2 Favored Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.59 179.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.71 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 86.9 Cg_exo -46.51 102.92 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 122.521 2.147 . . . . 0.0 112.547 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.079 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.149 179.983 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.603 -0.199 . . . . 0.0 112.603 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 17' ' ' ARG . 0.6 OUTLIER -104.75 92.47 4.28 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.19 0.519 . . . . 0.0 111.177 -179.832 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.695 ' HB ' ' HG2' ' A' ' 72' ' ' PRO . 1.6 m -88.71 101.25 11.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.202 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.518 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 0.3 OUTLIER -142.22 45.52 1.65 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.065 -179.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.648 ' O ' ' HA ' ' A' ' 72' ' ' PRO . 67.2 m95 -140.9 156.94 46.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.055 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -118.85 104.1 10.23 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.629 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 9.6 ttt180 -104.22 109.02 20.67 Favored 'General case' 0 CA--C 1.513 -0.455 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 38' ' ' ARG . . . -80.4 118.83 22.37 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.237 -0.892 . . . . 0.0 112.243 -178.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -87.61 -23.13 24.38 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.09 178.65 6.63 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.417 -1.265 . . . . 0.0 109.169 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -50.17 -179.22 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.237 0.541 . . . . 0.0 111.657 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 37' ' ' PHE . 38.6 p90 -101.24 146.51 27.43 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.104 -0.498 . . . . 0.0 112.242 -178.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.503 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 1.0 OUTLIER -98.69 11.16 39.41 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.428 179.745 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.615 ' HB1' ' HB3' ' A' ' 34' ' ' GLU . . . -69.24 103.03 1.83 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.057 0.455 . . . . 0.0 110.754 -179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 2.5 mt -110.32 -7.98 14.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.639 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.497 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 2.5 mm-40 -97.76 163.63 12.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.294 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -45.9 63.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.071 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.513 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -80.29 27.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.622 179.56 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -116.25 160.52 20.32 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.146 -179.572 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.725 HD21 ' HB2' ' A' ' 58' ' ' LEU . 13.1 tp -116.33 139.0 50.86 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.23 179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -116.41 131.62 9.66 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.631 -179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.655 ' HD2' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -117.75 -178.07 3.4 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.831 0.348 . . . . 0.0 110.661 179.346 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.483 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -130.56 174.43 9.91 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.21 179.449 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 35.7 t -56.74 142.06 41.77 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.151 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 56.86 47.33 87.15 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 121.181 -0.533 . . . . 0.0 112.872 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.567 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 65.5 mm-40 -130.04 136.59 49.55 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.873 0.368 . . . . 0.0 111.308 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 t -99.98 138.72 23.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.264 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.783 HG22 ' HG ' ' A' ' 58' ' ' LEU . 21.7 t -130.3 144.36 38.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.712 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -90.92 111.03 22.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.753 0.311 . . . . 0.0 110.616 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.518 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 69.2 t -80.32 134.76 26.73 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.816 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -111.59 -12.81 13.89 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.265 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -149.86 68.71 1.01 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.919 0.39 . . . . 0.0 111.345 -179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.447 ' HB3' HG11 ' A' ' 45' ' ' VAL . 0.4 OUTLIER -73.17 -3.15 24.84 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.765 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 13.5 t -75.03 113.71 12.66 Favored 'General case' 0 N--CA 1.443 -0.824 0 C-N-CA 119.313 -0.955 . . . . 0.0 108.577 178.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.469 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 4.0 m-20 160.73 158.29 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 114.693 -1.139 . . . . 0.0 108.848 -179.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -92.8 10.24 2.36 Favored 'Trans proline' 0 N--CA 1.453 -0.857 0 C-N-CA 122.246 1.964 . . . . 0.0 113.961 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -171.32 -60.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.747 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 44.9 m95 -97.31 118.95 34.91 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -178.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.469 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 27.5 m0 -112.23 146.43 38.17 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.44 178.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 24.2 m -91.51 116.66 29.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.715 179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.82 -176.33 18.73 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.371 -179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.616 ' HA ' HD22 ' A' ' 35' ' ' LEU . 3.4 ptt180 -147.39 140.02 24.79 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.156 0.503 . . . . 0.0 111.819 -179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.783 ' HG ' HG22 ' A' ' 43' ' ' VAL . 3.0 tt -99.35 113.43 25.75 Favored 'General case' 0 C--O 1.225 -0.217 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.012 179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.478 ' ND1' ' N ' ' A' ' 60' ' ' ASN . 7.9 p80 56.19 -67.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.577 0.751 . . . . 0.0 112.425 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . 0.478 ' N ' ' ND1' ' A' ' 59' ' ' HIS . 14.8 t30 -146.4 9.85 1.09 Allowed 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 118.406 0.548 . . . . 0.0 112.134 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 14.9 mtpt -109.37 125.79 52.74 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.6 -0.518 . . . . 0.0 109.6 179.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 1.2 mp -103.11 144.05 31.81 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.063 0.458 . . . . 0.0 111.626 -179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 165.7 157.11 9.72 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.657 -0.702 . . . . 0.0 112.68 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 33' ' ' ASP . 1.5 mt -70.84 154.35 41.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.709 0.29 . . . . 0.0 110.802 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.5 ' HB2' ' CZ ' ' A' ' 37' ' ' PHE . 2.2 p90 -143.78 161.26 47.07 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.214 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 62.0 Cg_endo -83.38 106.66 1.36 Allowed 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.81 2.34 . . . . 0.0 112.585 179.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.81 -13.24 61.97 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.004 0.431 . . . . 0.0 110.722 179.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.416 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -87.13 -23.44 24.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.686 179.883 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -84.5 -42.53 15.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.999 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.629 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.68 153.43 27.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.439 -179.542 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' ARG . . . -119.24 152.52 52.51 Favored Pre-proline 0 CA--C 1.53 0.18 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.663 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.695 ' HG2' ' HB ' ' A' ' 18' ' ' VAL . 52.7 Cg_exo -57.26 -179.07 0.1 OUTLIER 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 122.946 2.431 . . . . 0.0 113.925 -179.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 7.3 ttp -148.53 100.18 3.09 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.787 -179.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -71.73 106.91 4.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.662 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 44.7 mtp85 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.297 -0.859 . . . . 0.0 110.933 -179.961 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 120.611 0.244 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . 0.411 ' HB3' ' OD1' ' A' ' 68' ' ' ASN . 79.3 Cg_exo -48.52 104.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 122.646 2.23 . . . . 0.0 112.118 179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 19.0 t -87.97 119.17 28.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.087 0.47 . . . . 0.0 111.031 -179.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.416 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -105.68 136.95 37.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.188 -179.772 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.512 ' O ' HG22 ' B' ' 83' ' ' THR . 2.1 t0 -98.16 131.58 44.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.745 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.58 -5.66 50.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.088 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 4.6 t -78.0 3.66 14.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.44 -179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 80' ' ' ASP . 10.5 t -127.36 26.24 6.02 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.939 0.4 . . . . 0.0 111.501 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.482 ' HA ' ' HB2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -60.17 163.21 8.58 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.834 179.793 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.747 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.7 Cg_exo -48.61 101.98 0.05 OUTLIER 'Trans proline' 0 C--N 1.351 0.685 0 C-N-CA 122.49 2.127 . . . . 0.0 112.385 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.207 -0.901 . . . . 0.0 111.05 -179.923 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.248 0 N-CA-C 112.455 -0.258 . . . . 0.0 112.455 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.64 40.69 3.37 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.096 0.474 . . . . 0.0 110.843 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.671 HG12 ' HB2' ' A' ' 72' ' ' PRO . 0.1 OUTLIER -98.77 71.9 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.753 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.415 HH11 ' HD3' ' A' ' 19' ' ' ARG . 6.1 ptt180 -118.87 55.57 0.92 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.641 -179.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.804 ' HB2' ' H ' ' A' ' 73' ' ' MET . 86.6 m95 -141.29 157.21 45.52 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.302 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.86 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -132.29 104.84 6.96 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-O 120.808 0.337 . . . . 0.0 110.74 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.645 ' HA ' ' O ' ' A' ' 41' ' ' GLU . 7.4 ttp180 -105.15 109.8 21.94 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.637 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.405 ' HA ' ' HB ' ' A' ' 70' ' ' VAL . . . -79.81 128.73 33.79 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.202 -0.908 . . . . 0.0 111.994 -178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.4 mt -98.78 -16.17 19.02 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -140.99 178.39 7.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.343 179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.24 -179.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.343 0.592 . . . . 0.0 111.494 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.524 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.4 p90 -101.31 146.46 27.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.932 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.9 OUTLIER -98.07 10.5 40.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.672 -179.918 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.524 ' H ' ' HD2' ' A' ' 27' ' ' PHE . . . -69.59 102.62 1.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.113 0.482 . . . . 0.0 111.042 -179.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 3.6 mt -100.68 -15.9 17.57 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.072 179.647 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.481 ' HB2' ' CD ' ' A' ' 34' ' ' GLU . 3.2 mm-40 -98.5 167.17 10.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.864 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -85.11 -28.79 25.35 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.139 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -77.38 -3.05 38.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.055 0.455 . . . . 0.0 110.704 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.759 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 83.4 mt-10 -97.9 -172.63 2.41 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.693 -179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.573 HD11 ' HB3' ' A' ' 58' ' ' LEU . 13.3 tp -134.48 139.39 45.45 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.419 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -120.56 131.53 8.82 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.426 -0.892 . . . . 0.0 113.622 -179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.875 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -117.12 -174.56 2.62 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.916 0.389 . . . . 0.0 110.582 179.227 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.7 mtm180 -129.36 164.97 22.43 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.799 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -44.21 137.52 3.44 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.651 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 53.11 66.6 2.61 Favored Glycine 0 C--N 1.331 0.271 0 CA-C-N 115.749 -0.659 . . . . 0.0 113.061 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.645 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 3.6 mt-10 -136.73 142.26 43.06 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.917 0.389 . . . . 0.0 111.643 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 20.9 t -99.35 134.31 38.94 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.95 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.86 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 60.1 t -130.32 139.3 51.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.238 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.2 106.86 18.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.871 0.367 . . . . 0.0 110.406 179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.671 HG12 ' H ' ' A' ' 47' ' ' ASP . 24.4 t -80.2 139.51 18.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.496 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -116.9 14.18 15.09 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.671 ' H ' HG12 ' A' ' 45' ' ' VAL . 5.4 t70 -146.92 -65.33 0.28 Allowed 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 121.09 0.471 . . . . 0.0 111.616 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.624 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 1.9 p 56.84 -1.97 0.05 OUTLIER 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.64 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . 0.46 ' H ' ' C ' ' A' ' 47' ' ' ASP . 2.9 t -84.73 114.13 21.82 Favored 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.494 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 6.8 m-20 161.64 162.28 0.04 OUTLIER Pre-proline 0 C--N 1.329 -0.31 0 O-C-N 124.291 0.994 . . . . 0.0 108.983 -178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -94.89 10.97 1.66 Allowed 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 122.241 1.96 . . . . 0.0 113.458 -179.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.406 ' HB2' ' OG1' ' B' ' 83' ' ' THR . 0.5 OUTLIER -170.17 -62.38 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.465 ' CB ' ' HD3' ' B' ' 85' ' ' PRO . 70.1 m95 -96.67 121.43 38.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.845 0.355 . . . . 0.0 111.272 -179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.624 ' CG ' ' HA ' ' A' ' 48' ' ' SER . 46.9 m0 -110.41 149.36 30.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.157 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 2.1 m -89.71 116.12 27.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.905 179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -153.43 177.72 30.84 Favored Glycine 0 CA--C 1.518 0.235 0 N-CA-C 111.634 -0.586 . . . . 0.0 111.634 179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 22.7 ptt85 -133.56 135.16 44.16 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 117.436 0.618 . . . . 0.0 112.244 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.875 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.1 OUTLIER -99.65 115.22 28.94 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.564 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER 65.15 -78.47 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.983 179.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -145.07 14.14 1.47 Allowed 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 120.842 0.353 . . . . 0.0 111.219 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 4.9 mtpm? -112.54 127.06 55.97 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.986 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -102.53 146.37 28.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.927 0.394 . . . . 0.0 111.335 -179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 167.33 -163.72 37.34 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.631 -179.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.759 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.0 OUTLIER -109.59 130.9 55.47 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.688 0.28 . . . . 0.0 110.93 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.474 ' CZ ' ' HB2' ' A' ' 21' ' ' ALA . 3.4 p90 -117.88 162.87 27.11 Favored Pre-proline 0 CA--C 1.532 0.269 0 CA-C-O 120.73 0.3 . . . . 0.0 111.346 -179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.522 ' CB ' HG13 ' B' ' 79' ' ' ILE . 65.5 Cg_endo -79.4 108.23 2.3 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.037 2.491 . . . . 0.0 112.825 179.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.7 -11.29 60.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.905 0.383 . . . . 0.0 110.615 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.408 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -90.22 -31.8 16.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -77.14 -41.06 43.31 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.551 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.56 ' HB ' ' O ' ' A' ' 22' ' ' ARG . 1.0 OUTLIER -122.34 158.04 26.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.839 0.352 . . . . 0.0 111.258 -179.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.32 148.21 41.17 Favored Pre-proline 0 N--CA 1.462 0.159 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.088 -179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.677 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 52.0 Cg_exo -55.0 176.42 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.48 2.12 . . . . 0.0 113.79 -179.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.804 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 0.8 OUTLIER -141.0 99.51 3.61 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.771 -1.104 . . . . 0.0 110.532 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.32 105.55 5.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.822 0.344 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 10.4 ptt180 . . . . . 0 C--O 1.248 0.994 0 CA-C-O 118.249 -0.881 . . . . 0.0 110.947 179.858 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.63 0.252 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.4 127.6 19.43 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.666 2.244 . . . . 0.0 112.297 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.91 127.28 36.33 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.132 0.492 . . . . 0.0 111.039 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.522 HG13 ' CB ' ' A' ' 66' ' ' PRO . 0.3 OUTLIER -115.82 139.04 44.25 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.683 -179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -107.06 109.91 21.9 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.621 179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.587 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 20.1 mtm-85 -70.19 -5.29 26.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.526 -179.686 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 5.1 m -81.86 4.15 23.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.934 -179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.406 ' OG1' ' HB2' ' A' ' 52' ' ' SER . 1.0 OUTLIER -122.11 22.86 10.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.986 -179.224 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.587 ' HD3' ' O ' ' B' ' 81' ' ' ARG . 11.3 mtpt -55.02 152.51 13.81 Favored Pre-proline 0 C--N 1.331 -0.236 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.942 179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.596 ' HG2' HD22 ' A' ' 64' ' ' LEU . 82.6 Cg_exo -45.09 102.61 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 122.611 2.207 . . . . 0.0 112.552 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.272 -0.871 . . . . 0.0 111.024 -179.905 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.184 0 N-CA-C 112.374 -0.291 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 48.05 35.42 5.15 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.479 0.657 . . . . 0.0 110.706 179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.488 HG12 ' CB ' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -88.34 106.6 16.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 115.031 -0.986 . . . . 0.0 110.881 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.5 ' C ' ' HB ' ' A' ' 45' ' ' VAL . 2.2 ptt85 -150.25 61.62 0.97 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TRP . . . . . 0.763 ' HB2' ' H ' ' A' ' 73' ' ' MET . 80.5 m95 -140.47 157.26 45.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.609 -179.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.769 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . . . -129.04 104.17 7.42 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.559 ' O ' ' HB ' ' A' ' 70' ' ' VAL . 0.2 OUTLIER -106.05 109.49 21.45 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 179.215 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HA ' ' CG1' ' A' ' 70' ' ' VAL . . . -77.17 133.86 38.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.154 -0.93 . . . . 0.0 112.041 -178.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 13.1 mt -104.68 -10.6 17.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 178.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.13 178.97 7.81 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 114.272 -1.331 . . . . 0.0 109.122 179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.7 t0 -50.09 -177.27 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 121.279 0.561 . . . . 0.0 111.718 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.485 ' HD2' ' H ' ' A' ' 29' ' ' ALA . 35.8 p90 -100.92 146.53 27.24 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.067 0.461 . . . . 0.0 112.228 -178.813 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.553 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 0.7 OUTLIER -100.68 11.85 38.67 Favored 'General case' 0 N--CA 1.461 0.076 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.378 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.71 ' HB1' ' OE2' ' A' ' 34' ' ' GLU . . . -70.12 103.35 2.29 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.859 0.361 . . . . 0.0 111.049 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 28' ' ' GLU . 0.7 OUTLIER -115.77 -1.11 12.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.988 -179.973 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.547 ' HG3' ' HE3' ' B' ' 84' ' ' LYS . 0.0 OUTLIER -88.06 -178.86 6.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.976 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -100.78 -11.91 19.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.581 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -116.01 24.32 11.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.904 0.383 . . . . 0.0 111.031 -179.784 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.882 ' HA ' ' H ' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -111.79 -168.84 1.36 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.161 0.505 . . . . 0.0 111.596 -179.56 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.45 HD21 ' HB3' ' A' ' 58' ' ' LEU . 0.6 OUTLIER -142.91 139.31 30.71 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.655 179.24 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -113.72 130.07 9.17 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.316 -0.945 . . . . 0.0 113.463 -179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.785 ' HB3' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -106.81 -170.65 1.75 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.826 0.346 . . . . 0.0 110.47 179.178 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -129.66 171.55 12.52 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.842 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.8 t -57.29 130.94 48.43 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.999 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.65 63.9 3.94 Favored Glycine 0 C--N 1.33 0.198 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.996 179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.552 ' O ' ' HA ' ' A' ' 22' ' ' ARG . 60.0 mm-40 -141.69 137.08 31.48 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.954 0.407 . . . . 0.0 111.486 179.849 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.7 t -93.43 136.26 25.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.779 179.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.769 ' HB ' ' HB3' ' A' ' 21' ' ' ALA . 59.1 t -130.16 141.99 44.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.329 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -92.73 110.16 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.265 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.5 ' HB ' ' C ' ' A' ' 19' ' ' ARG . 95.6 t -80.17 136.08 24.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.054 -179.718 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 mt -112.77 -3.71 14.16 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.187 -179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -158.02 74.77 0.73 Allowed 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.898 0.38 . . . . 0.0 111.425 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.435 ' HA ' ' CG ' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -75.56 -3.94 37.13 Favored 'General case' 0 CA--C 1.511 -0.546 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.821 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.4 m -73.93 113.67 11.36 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 119.116 -1.034 . . . . 0.0 108.516 178.661 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.492 ' HB2' ' HD1' ' A' ' 54' ' ' TRP . 3.6 m-20 161.5 162.01 0.04 OUTLIER Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 114.61 -1.177 . . . . 0.0 108.755 -179.245 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -92.09 -2.45 4.09 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 121.975 1.783 . . . . 0.0 114.522 -178.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -167.95 -38.95 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.862 ' HB3' ' HD3' ' B' ' 85' ' ' PRO . 31.5 m95 -110.63 113.73 26.57 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 121.006 -0.278 . . . . 0.0 111.725 -179.094 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.492 ' HD1' ' HB2' ' A' ' 50' ' ' ASN . 18.9 m0 -111.06 143.28 42.02 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.416 178.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 10.7 m -89.91 116.49 28.01 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.829 0.347 . . . . 0.0 111.085 179.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -141.18 -175.19 14.65 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 121.087 -0.577 . . . . 0.0 111.98 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.451 ' C ' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -138.39 131.87 30.58 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 117.247 0.523 . . . . 0.0 112.041 -179.701 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.785 HD13 ' HB3' ' A' ' 37' ' ' PHE . 0.2 OUTLIER -100.89 120.76 40.62 Favored 'General case' 0 CA--C 1.52 -0.182 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.821 179.72 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 64.32 -77.9 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.196 0 O-C-N 123.195 0.31 . . . . 0.0 110.933 179.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 -149.78 17.0 0.89 Allowed 'General case' 0 C--N 1.332 -0.154 0 CA-C-O 120.912 0.386 . . . . 0.0 110.74 179.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.417 ' O ' HD22 ' A' ' 35' ' ' LEU . 2.7 mtpp -114.39 125.95 54.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.853 179.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -103.72 136.74 42.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.928 0.394 . . . . 0.0 111.552 -179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 170.58 166.17 29.06 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.864 179.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.882 ' H ' ' HA ' ' A' ' 34' ' ' GLU . 0.3 OUTLIER -63.67 160.84 16.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.939 0.399 . . . . 0.0 111.705 -179.684 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PHE . . . . . 0.478 ' HB2' ' CE2' ' A' ' 37' ' ' PHE . 1.5 p90 -155.51 155.83 30.16 Favored Pre-proline 0 CA--C 1.53 0.19 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.739 179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.563 ' HD2' ' HZ ' ' A' ' 37' ' ' PHE . 72.4 Cg_endo -79.2 107.96 2.29 Favored 'Trans proline' 0 C--N 1.347 0.474 0 C-N-CA 122.782 2.321 . . . . 0.0 112.577 179.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.419 ' HA ' ' CE1' ' A' ' 65' ' ' PHE . . . -68.25 -11.92 60.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.855 0.359 . . . . 0.0 110.882 179.607 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.637 ' HB3' HG12 ' B' ' 79' ' ' ILE . 0.0 OUTLIER -89.76 -33.91 16.38 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.657 179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -73.73 -40.35 63.62 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.158 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.697 HG21 ' HB1' ' A' ' 21' ' ' ALA . 1.1 m -122.53 152.66 26.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-O 120.826 0.346 . . . . 0.0 111.442 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.28 150.28 45.04 Favored Pre-proline 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.486 -179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.697 ' HA ' ' O ' ' A' ' 20' ' ' TRP . 76.6 Cg_exo -53.35 175.25 0.1 Allowed 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.824 2.349 . . . . 0.0 113.982 -179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . 0.763 ' H ' ' HB2' ' A' ' 20' ' ' TRP . 7.2 tmm? -152.16 103.97 2.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.96 -1.018 . . . . 0.0 110.945 -178.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 ttp -74.13 105.93 5.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.784 0.325 . . . . 0.0 110.74 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.469 ' NH1' ' HB2' ' A' ' 75' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.28 -0.867 . . . . 0.0 110.948 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.634 0.254 . . . . 0.0 111.11 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -57.33 129.22 32.94 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.648 2.232 . . . . 0.0 112.208 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' SER . . . . . . . . . . . . . 29.5 t -109.49 123.92 50.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.05 0.453 . . . . 0.0 111.067 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' ILE . . . . . 0.637 HG12 ' HB3' ' A' ' 68' ' ' ASN . 0.2 OUTLIER -115.58 135.67 54.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.243 -179.78 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.493 ' O ' HG22 ' B' ' 83' ' ' THR . 0.5 OUTLIER -107.58 134.44 50.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.564 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ARG . . . . . 0.425 ' O ' ' HD3' ' B' ' 84' ' ' LYS . 14.9 mtm-85 -74.61 -5.62 44.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.072 -179.84 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 13.4 p -76.13 3.25 10.95 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.631 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' THR . . . . . 0.58 HG23 ' HD1' ' A' ' 53' ' ' TRP . 9.8 t -129.32 26.41 5.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.952 0.406 . . . . 0.0 111.303 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' LYS . . . . . 0.547 ' HE3' ' HG3' ' A' ' 31' ' ' GLU . 1.3 mtpt -61.14 160.9 19.12 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.92 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' PRO . . . . . 0.862 ' HD3' ' HB3' ' A' ' 53' ' ' TRP . 71.2 Cg_exo -49.54 99.33 0.04 OUTLIER 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.591 2.194 . . . . 0.0 112.506 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.229 -0.891 . . . . 0.0 111.04 179.877 . . . . . . . . 0 0 . 1 stop_ save_